data_1jgn_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 1jgn _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.829 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 9.0 t . . . . . 0 N--CA 1.455 -0.192 0 CA-C-O 120.668 0.271 . . . . 0.0 110.355 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.42 -37.77 78.93 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 176.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 42.5 t -69.44 -35.08 75.33 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.683 177.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.829 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.2 mtm -64.41 -38.61 91.65 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.117 178.223 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.678 ' HA ' ' HE2' ' A' ' 23' ' ' MET . 46.1 mt -52.42 -49.31 64.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.211 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.55 -30.53 70.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.146 178.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.445 ' HG ' ' HA ' ' A' ' 11' ' ' MET . 2.5 p -101.44 17.92 21.46 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.763 -178.473 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.628 ' HB3' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.067 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.628 ' HB3' ' HB3' ' A' ' 15' ' ' ALA . 0.4 OUTLIER . . . . . 0 N--CA 1.457 -0.093 0 CA-C-O 120.741 0.305 . . . . 0.0 111.023 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.634 HE22 ' HB3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -51.52 -63.56 1.1 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.13 179.76 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.602 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -55.97 -19.55 12.87 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.643 -178.239 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.546 ' N ' ' HE2' ' A' ' 21' ' ' LYS . 24.1 tt0 -73.61 -80.48 0.07 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.085 0.469 . . . . 0.0 111.465 179.039 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' MET . . . . . 0.678 ' HE2' ' HA ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.8 -95.24 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.816 -176.807 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.721 HD11 ' HD3' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -60.47 -1.37 0.35 Allowed 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -175.522 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.541 ' O ' HD22 ' A' ' 24' ' ' LEU . . . 64.76 -116.04 8.52 Favored Glycine 0 N--CA 1.446 -0.68 0 N-CA-C 108.423 -1.871 . . . . 0.0 108.423 -174.653 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.71 ' HG3' HD23 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -75.97 -69.4 0.5 Allowed 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 168.765 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.775 ' HG3' HD21 ' A' ' 31' ' ' LEU . 0.5 OUTLIER -160.06 9.99 0.11 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.226 -1.352 . . . . 0.0 108.002 175.007 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.837 HD23 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.41 -74.88 0.06 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.146 -1.388 . . . . 0.0 114.012 -173.456 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.586 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -34.54 -49.2 0.97 Allowed Pre-proline 0 CA--C 1.537 0.465 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -175.754 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.58 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 52.1 Cg_exo -57.68 -44.68 39.14 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.297 1.998 . . . . 0.0 113.424 -179.025 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.775 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.75 -44.07 67.54 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.178 -178.371 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.697 HD11 ' HB ' ' A' ' 43' ' ' ILE . 0.3 OUTLIER -76.19 -12.72 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.13 178.021 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.63 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 3.2 tp60 -62.58 -37.41 86.09 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 176.37 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.78 -32.39 72.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.25 -0.887 . . . . 0.0 108.934 174.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' MET . . . . . 0.499 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 7.3 mtt -100.34 27.96 5.33 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.221 177.842 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.63 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 2.1 p-80 -63.77 -32.61 8.2 Favored Pre-proline 0 CA--C 1.536 0.442 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -177.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.538 ' CD ' ' N ' ' A' ' 36' ' ' HIS . 62.0 Cg_exo -38.24 -28.57 0.12 Allowed 'Trans proline' 0 C--N 1.362 1.244 0 C-N-CA 122.224 1.949 . . . . 0.0 112.229 179.412 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.869 HG23 HG13 ' A' ' 73' ' ' VAL . 7.1 m -78.08 -86.54 0.06 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.874 176.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.507 HD21 HD12 ' A' ' 76' ' ' LEU . 2.6 tp -171.46 49.7 0.02 OUTLIER 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.065 178.409 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.441 ' CA ' HG13 ' A' ' 43' ' ' ILE . . . -32.5 -46.5 0.14 Allowed 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 112.262 0.468 . . . . 0.0 112.262 -178.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.586 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -44.72 -59.12 4.45 Favored Glycine 0 C--N 1.33 0.216 0 CA-C-N 116.132 -0.485 . . . . 0.0 114.127 -178.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.719 ' HB3' HD13 ' A' ' 76' ' ' LEU . 0.5 OUTLIER -76.66 -27.08 55.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 117.032 0.416 . . . . 0.0 111.798 -177.646 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.717 HG12 HD22 ' A' ' 76' ' ' LEU . 0.9 OUTLIER -57.83 -56.34 16.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.735 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.837 ' HA ' HD23 ' A' ' 28' ' ' LEU . 12.3 t -50.54 -40.55 52.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.47 179.239 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.64 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -50.5 -68.41 1.46 Allowed Glycine 0 N--CA 1.451 -0.304 0 CA-C-N 115.913 -0.585 . . . . 0.0 113.28 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.42 ' H ' ' HG2' ' A' ' 46' ' ' MET . 0.0 OUTLIER -55.61 -49.34 73.05 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 122.809 -0.23 . . . . 0.0 111.493 -178.365 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.831 HD13 ' HB3' ' B' ' 6' ' ' LEU . 2.3 mm? -79.94 9.62 5.17 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -178.366 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.608 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.96 -22.01 66.45 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.946 0.403 . . . . 0.0 110.606 179.276 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.557 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 3.4 mm-40 -74.63 21.72 0.11 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.062 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.497 ' H ' ' C ' ' A' ' 48' ' ' LEU . 2.6 tt -83.24 165.1 2.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.795 179.584 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.472 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 20.4 m-20 -70.79 156.38 39.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.862 0.363 . . . . 0.0 111.573 -179.109 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.583 ' HA ' HD23 ' A' ' 55' ' ' LEU . 5.1 m120 -88.9 -28.24 20.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.778 177.391 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.4 t -74.03 -30.18 62.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.664 177.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.472 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 4.9 mm-40 -80.11 -26.9 39.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.592 178.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.71 HD23 ' HG3' ' A' ' 26' ' ' GLU . 0.8 OUTLIER -59.16 -46.61 87.93 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.872 0.368 . . . . 0.0 110.052 179.636 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.428 ' HA ' HD22 ' A' ' 56' ' ' LEU . 0.2 OUTLIER -64.4 -41.31 96.72 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.468 179.19 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.507 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 7.0 t60 -64.5 -30.39 71.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.267 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.67 ' HE2' ' HD3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -65.89 -45.24 82.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.869 -179.667 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.614 HD21 ' NE ' ' A' ' 27' ' ' ARG . 0.1 OUTLIER -66.38 -18.49 65.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.787 179.398 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.507 ' HG2' ' O ' ' A' ' 57' ' ' HIS . 4.1 pt-20 -100.14 -8.05 24.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.234 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.635 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.9 OUTLIER -125.38 88.1 54.68 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.946 179.737 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -60.06 -33.07 95.55 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.278 1.985 . . . . 0.0 112.23 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -78.0 -49.34 14.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.59 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 68.3 m -69.69 -32.24 70.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.888 0.375 . . . . 0.0 111.336 -178.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.635 ' HB3' ' O ' ' A' ' 61' ' ' SER . 1.1 tp -73.34 -65.23 0.84 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.598 -178.512 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.589 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -49.02 -29.67 5.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.186 -177.839 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.531 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.2 OUTLIER -65.43 -43.79 89.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.101 0.477 . . . . 0.0 110.286 178.292 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.67 ' HD3' ' HE2' ' A' ' 58' ' ' MET . 22.1 mtpt -65.86 -55.86 14.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.626 179.208 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.756 ' HA ' ' HB1' ' A' ' 72' ' ' ALA . 53.2 t -65.01 -19.74 26.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.662 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.531 ' HB3' ' O ' ' A' ' 67' ' ' SER . 7.2 t70 -55.83 -48.52 75.3 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 176.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -67.06 -33.97 76.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.637 176.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.756 ' HB1' ' HA ' ' A' ' 69' ' ' VAL . . . -55.55 -44.73 77.06 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.651 178.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.869 HG13 HG23 ' A' ' 38' ' ' THR . 11.7 t -60.0 -32.49 50.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.936 177.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.43 -36.38 65.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.629 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.705 HG11 ' HA ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.15 -28.84 35.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 120.922 0.391 . . . . 0.0 110.268 179.968 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.719 HD13 ' HB3' ' A' ' 42' ' ' LYS . 3.4 mm? -71.91 -54.32 10.39 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.802 178.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 25.5 mm100 -51.3 -36.63 43.35 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.469 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.48 -26.14 35.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.873 178.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 60.6 t60 . . . . . 0 C--N 1.331 -0.223 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.21 -179.423 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.756 0.312 . . . . 0.0 110.944 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.831 ' HB3' HD13 ' A' ' 47' ' ' LEU . 17.6 tp -68.94 -76.53 0.09 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.777 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 7' ' ' ASN . . . . . 0.814 ' HB2' HD12 ' A' ' 47' ' ' LEU . 1.6 t30 -88.55 135.96 31.89 Favored Pre-proline 0 C--N 1.331 -0.197 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.856 179.38 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 5.7 Cg_exo -79.68 -3.65 13.01 Favored 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 122.73 2.287 . . . . 0.0 111.974 179.245 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 9' ' ' ASN . . . . . 0.575 ' H ' HD21 ' B' ' 7' ' ' ASN . 9.6 m-20 -123.16 51.09 1.48 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.174 -179.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . 0.407 ' HB3' ' HB3' ' A' ' 46' ' ' MET . . . -60.23 93.69 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.746 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.557 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 3.0 mttp -124.94 154.08 41.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.376 178.521 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -54.51 166.12 0.48 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.808 0.337 . . . . 0.0 111.316 -179.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' PHE . . . . . 0.64 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.1 t80 . . . . . 0 C--N 1.331 -0.216 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.761 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.634 ' HB3' HE22 ' A' ' 20' ' ' GLN . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.846 0.355 . . . . 0.0 110.79 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 1.3 t80 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.957 -179.812 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.849 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 9.7 t . . . . . 0 N--CA 1.455 -0.177 0 CA-C-O 120.581 0.229 . . . . 0.0 110.404 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.99 -34.49 71.9 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 177.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.82 -35.72 70.01 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.608 177.151 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.849 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 3.6 mtm -64.6 -38.09 89.83 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.189 177.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 8' ' ' THR . 68.8 mt -52.69 -50.78 62.64 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.003 179.463 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.5 -26.6 67.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.715 177.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.43 18.12 20.94 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.645 -178.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.633 ' HB3' ' O ' ' A' ' 11' ' ' MET . . . . . . . . 0 CA--C 1.532 0.283 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.994 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.749 ' HG3' ' HB3' ' A' ' 22' ' ' GLN . 0.9 OUTLIER . . . . . 0 N--CA 1.455 -0.202 0 CA-C-O 120.59 0.233 . . . . 0.0 111.029 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.537 HE22 ' HG2' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -46.86 -61.37 1.89 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.286 -178.96 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.557 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -56.11 -25.11 44.57 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.685 -178.282 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.749 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 0.7 OUTLIER -73.26 -77.04 0.11 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.834 0.35 . . . . 0.0 111.627 179.921 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' MET . . . . . 0.718 ' HA ' ' HE1' ' A' ' 11' ' ' MET . 0.0 OUTLIER -68.99 -95.91 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -176.483 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.681 HD11 ' HD3' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -61.9 -1.8 0.73 Allowed 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -175.515 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.568 ' O ' HD22 ' A' ' 24' ' ' LEU . . . 64.8 -116.64 9.21 Favored Glycine 0 N--CA 1.446 -0.688 0 N-CA-C 108.535 -1.826 . . . . 0.0 108.535 -174.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.704 ' HG3' HD21 ' A' ' 55' ' ' LEU . 0.9 OUTLIER -76.13 -69.97 0.47 Allowed 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 169.052 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.681 ' HD3' HD11 ' A' ' 24' ' ' LEU . 7.4 tpt180 -159.96 13.52 0.13 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.4 -1.273 . . . . 0.0 108.044 175.566 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.634 ' HA ' HD13 ' A' ' 31' ' ' LEU . 4.1 mm? -57.3 -78.85 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.406 -1.27 . . . . 0.0 113.574 -173.439 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.634 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -36.05 -49.58 1.61 Allowed Pre-proline 0 CA--C 1.537 0.469 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -175.676 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.563 ' HG2' ' HD2' ' A' ' 27' ' ' ARG . 55.0 Cg_exo -55.29 -43.05 62.45 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.25 1.966 . . . . 0.0 113.611 -178.407 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.634 HD13 ' HA ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -71.18 -48.44 51.67 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.065 0.459 . . . . 0.0 110.336 -178.493 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.678 HG12 HG11 ' A' ' 69' ' ' VAL . 0.3 OUTLIER -71.87 -14.26 17.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.091 178.672 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.626 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.3 OUTLIER -62.24 -40.77 97.29 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 176.893 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.38 -30.51 71.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.166 174.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' MET . . . . . 0.621 ' HE2' ' HA ' ' A' ' 66' ' ' ARG . 5.7 mtt -103.15 27.2 7.4 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.394 178.48 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.626 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 2.4 p-80 -62.92 -32.55 9.05 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -177.486 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.555 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 57.2 Cg_exo -36.0 -32.94 0.11 Allowed 'Trans proline' 0 C--N 1.362 1.266 0 C-N-CA 122.221 1.948 . . . . 0.0 112.199 179.014 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 62.6 m -78.18 -88.38 0.05 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.83 176.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.588 ' HB2' HD13 ' A' ' 76' ' ' LEU . 0.1 OUTLIER -171.31 61.06 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.513 178.324 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.504 ' HB3' ' O ' ' A' ' 32' ' ' ILE . . . -47.02 -31.99 3.65 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.838 0.351 . . . . 0.0 111.508 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.634 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -43.24 -68.38 0.81 Allowed Glycine 0 CA--C 1.519 0.315 0 CA-C-N 115.697 -0.683 . . . . 0.0 114.597 -178.178 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.717 ' NZ ' ' HA ' ' B' ' 12' ' ' GLU . 0.7 OUTLIER -77.58 -29.16 51.92 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -176.809 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.742 HD12 ' HA ' ' A' ' 73' ' ' VAL . 37.6 mt -53.75 -52.16 37.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 121.157 -0.217 . . . . 0.0 111.378 -178.656 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.531 HG23 ' O ' ' A' ' 41' ' ' GLY . 5.6 t -48.17 -45.73 33.89 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.98 0.419 . . . . 0.0 110.293 178.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.706 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -52.07 -60.48 7.56 Favored Glycine 0 N--CA 1.453 -0.232 0 CA-C-N 115.623 -0.717 . . . . 0.0 113.76 -179.512 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.619 ' SD ' ' HE3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.74 -52.85 62.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.703 0.252 . . . . 0.0 111.52 -178.215 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.694 HD22 ' HB2' ' A' ' 72' ' ' ALA . 1.7 mm? -80.32 7.94 8.52 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -178.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.475 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.08 -15.15 62.83 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.922 0.391 . . . . 0.0 110.573 179.423 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -79.59 20.49 0.57 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.842 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.513 HG22 ' HG2' ' A' ' 26' ' ' GLU . 0.2 OUTLIER -83.43 161.43 3.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.745 -179.942 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.44 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 3.5 m-20 -68.27 157.06 36.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.821 -178.419 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.523 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 6.2 m120 -82.4 -31.42 29.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.149 178.037 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.48 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 1.0 OUTLIER -74.08 -30.86 62.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.348 0.594 . . . . 0.0 109.783 177.613 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.559 ' O ' ' HG2' ' A' ' 58' ' ' MET . 0.0 OUTLIER -78.77 -26.11 44.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.431 178.904 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.704 HD21 ' HG3' ' A' ' 26' ' ' GLU . 0.7 OUTLIER -61.42 -49.51 76.58 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.674 -179.885 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.572 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 1.2 pp -62.81 -39.02 92.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.956 0.407 . . . . 0.0 110.69 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.615 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 13.2 t60 -62.37 -20.38 64.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.959 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.644 ' HE3' ' HZ2' ' A' ' 68' ' ' LYS . 24.9 mmt -76.62 -51.58 11.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.115 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 56' ' ' LEU . 3.9 pp -64.48 -10.5 25.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.911 0.386 . . . . 0.0 110.429 179.22 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.615 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 0.0 OUTLIER -106.66 -8.22 17.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.747 179.501 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.597 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 3.3 m -122.82 79.93 49.39 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.203 -179.519 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -56.11 -32.75 87.94 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.161 1.907 . . . . 0.0 111.671 178.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -78.53 -51.54 9.81 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.891 -179.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.597 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 20.0 m -69.18 -52.07 31.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.951 0.405 . . . . 0.0 111.554 -177.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.626 HD21 HD11 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -57.81 -59.44 5.22 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.373 -178.535 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.621 ' HA ' ' HE2' ' A' ' 35' ' ' MET . 0.7 OUTLIER -50.02 -33.18 17.26 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.116 -177.949 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.585 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 6.5 t -68.23 -39.1 82.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.2 0.524 . . . . 0.0 110.255 178.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.644 ' HZ2' ' HE3' ' A' ' 58' ' ' MET . 1.6 ttpt -65.91 -59.12 4.16 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.434 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.809 ' HA ' ' HB1' ' A' ' 72' ' ' ALA . 42.1 t -62.57 -19.28 22.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.516 178.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.59 ' O ' HG21 ' A' ' 73' ' ' VAL . 18.5 t70 -54.88 -48.81 72.52 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 176.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -68.88 -26.85 65.33 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.503 -0.772 . . . . 0.0 109.844 176.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.809 ' HB1' ' HA ' ' A' ' 69' ' ' VAL . . . -63.68 -47.09 82.61 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.185 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.742 ' HA ' HD12 ' A' ' 43' ' ' ILE . 3.4 m -60.08 -28.87 42.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 177.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.39 -40.13 74.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.066 178.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.739 HG12 ' HA ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -55.61 -35.45 38.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 CA-C-O 121.102 0.477 . . . . 0.0 109.811 178.862 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.588 HD13 ' HB2' ' A' ' 39' ' ' LEU . 2.9 tm? -69.28 -47.28 65.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.754 177.673 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 20.1 mm-40 -52.07 -36.54 50.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.21 178.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.29 -27.46 35.06 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.63 178.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 79.1 t60 . . . . . 0 C--N 1.332 -0.191 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.496 179.347 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.768 0.318 . . . . 0.0 110.98 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.595 HD21 ' O ' ' A' ' 68' ' ' LYS . 5.3 tp -68.66 -74.78 0.12 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.865 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' ASN . . . . . 0.528 ' HB2' HD13 ' A' ' 47' ' ' LEU . 2.0 t30 -92.68 134.62 27.47 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.7 179.244 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -80.18 -4.17 13.04 Favored 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 122.297 1.998 . . . . 0.0 112.389 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 9' ' ' ASN . . . . . 0.506 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 18.0 m120 -123.28 50.9 1.51 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.852 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.96 96.06 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.219 -0.446 . . . . 0.0 112.068 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.0 OUTLIER -119.07 164.71 15.11 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.685 0.279 . . . . 0.0 110.477 177.445 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . 0.717 ' HA ' ' NZ ' ' A' ' 42' ' ' LYS . 0.7 OUTLIER -62.67 161.86 11.6 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.284 -179.352 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' PHE . . . . . 0.706 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.1 t80 . . . . . 0 C--N 1.332 -0.193 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.71 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.557 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.83 0.348 . . . . 0.0 110.622 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.777 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.752 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 15.3 t . . . . . 0 CA--C 1.521 -0.154 0 CA-C-O 120.641 0.257 . . . . 0.0 110.626 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.45 ' N ' HG22 ' A' ' 8' ' ' THR . . . -58.82 -33.49 70.46 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.228 0.537 . . . . 0.0 109.628 177.448 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 14.3 t -74.1 -35.93 64.22 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.874 177.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.752 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.6 mtm -64.37 -36.48 84.26 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.038 177.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.514 ' HA ' ' HE3' ' A' ' 23' ' ' MET . 50.5 mt -53.02 -53.83 44.25 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.93 178.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.29 -25.14 66.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.667 177.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.9 t -101.56 24.65 9.43 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.706 -178.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.533 ' HB3' ' O ' ' A' ' 11' ' ' MET . . . . . . . . 0 CA--C 1.533 0.302 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.915 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.678 ' HG3' ' HB3' ' A' ' 22' ' ' GLN . 1.6 tp10 . . . . . 0 N--CA 1.456 -0.154 0 CA-C-O 120.584 0.231 . . . . 0.0 110.985 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.679 HE22 ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -47.33 -55.08 9.48 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.482 -178.725 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.679 ' HG3' HE22 ' A' ' 20' ' ' GLN . 0.0 OUTLIER -55.79 -26.4 45.89 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.779 -178.444 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.678 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 0.6 OUTLIER -72.47 -76.75 0.11 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.765 0.317 . . . . 0.0 111.643 -179.44 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' MET . . . . . 0.582 ' HA ' ' HE2' ' A' ' 11' ' ' MET . 0.0 OUTLIER -69.16 -96.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -176.841 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.596 HD22 HH11 ' A' ' 27' ' ' ARG . 0.4 OUTLIER -62.07 -1.95 0.81 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 113.596 0.962 . . . . 0.0 113.596 -175.219 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 65.05 -115.75 8.12 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 108.497 -1.841 . . . . 0.0 108.497 -174.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.802 ' HG3' HD22 ' A' ' 55' ' ' LEU . 0.5 OUTLIER -75.98 -69.9 0.47 Allowed 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 168.995 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.596 HH11 HD22 ' A' ' 24' ' ' LEU . 9.5 tpt180 -159.7 13.22 0.14 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 114.282 -1.326 . . . . 0.0 108.029 175.256 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.747 ' HA ' HD12 ' A' ' 31' ' ' LEU . 3.9 mm? -57.32 -76.46 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.513 -1.221 . . . . 0.0 113.506 -174.218 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.626 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -37.25 -49.87 2.36 Favored Pre-proline 0 CA--C 1.535 0.381 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -175.122 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.555 ' HG2' ' HD2' ' A' ' 27' ' ' ARG . 50.0 Cg_exo -56.71 -43.64 52.86 Favored 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 122.249 1.966 . . . . 0.0 113.64 -177.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.747 HD12 ' HA ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -70.66 -47.39 60.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.141 0.496 . . . . 0.0 110.185 -178.432 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.746 HD11 ' HB ' ' A' ' 43' ' ' ILE . 0.5 OUTLIER -75.36 -13.16 15.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.499 178.845 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.657 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 8.7 tp-100 -62.59 -39.55 94.07 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 177.025 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.55 -31.93 72.95 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.266 -0.879 . . . . 0.0 108.814 174.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' MET . . . . . 0.64 ' SD ' HG12 ' A' ' 69' ' ' VAL . 6.2 mtt -100.73 27.2 6.08 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.409 177.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.657 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.9 p-80 -64.06 -33.19 8.92 Favored Pre-proline 0 CA--C 1.535 0.399 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 -177.097 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.544 ' HD3' ' ND1' ' A' ' 36' ' ' HIS . 53.2 Cg_exo -37.11 -30.39 0.11 Allowed 'Trans proline' 0 C--N 1.361 1.187 0 C-N-CA 122.286 1.991 . . . . 0.0 112.36 179.557 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.508 HG23 HG11 ' A' ' 73' ' ' VAL . 90.2 m -78.28 -85.17 0.07 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.238 177.33 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.511 ' O ' HG13 ' A' ' 43' ' ' ILE . 7.9 tp -171.11 51.29 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.21 178.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.505 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -39.83 -38.18 0.64 Allowed 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.852 -179.547 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.626 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.08 -55.72 9.87 Favored Glycine 0 C--N 1.331 0.289 0 CA-C-N 116.096 -0.502 . . . . 0.0 114.012 -179.174 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.494 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -78.27 -34.27 49.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 117.098 0.449 . . . . 0.0 111.817 -178.654 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.747 HG12 HD22 ' A' ' 76' ' ' LEU . 0.9 OUTLIER -54.11 -55.84 12.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.613 0.245 . . . . 0.0 111.238 -179.083 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.507 HG21 ' CD2' ' A' ' 29' ' ' PHE . 5.2 t -47.22 -49.17 23.67 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.477 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.565 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -50.23 -51.44 30.98 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 121.092 -0.575 . . . . 0.0 112.901 179.149 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.497 ' H ' ' HG2' ' A' ' 46' ' ' MET . 3.1 mmm -55.72 -68.05 0.23 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.332 0.587 . . . . 0.0 111.364 -179.404 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.816 HD12 ' HB2' ' B' ' 6' ' ' LEU . 4.0 mm? -74.15 10.62 1.16 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.184 -0.917 . . . . 0.0 111.701 -177.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.514 ' HB3' ' HD2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -66.17 -24.39 66.64 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.972 0.415 . . . . 0.0 110.302 178.835 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.469 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 3.0 mt-10 -74.59 22.38 0.1 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.967 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.494 ' H ' ' C ' ' A' ' 48' ' ' LEU . 2.6 tt -83.63 166.87 2.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.76 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.437 ' HB2' ' HG3' ' A' ' 54' ' ' GLU . 7.6 m-20 -70.82 155.29 40.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.419 -179.422 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.613 ' HA ' HD22 ' A' ' 55' ' ' LEU . 4.8 m120 -83.21 -29.62 28.38 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.064 178.062 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.06 -31.88 63.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.747 177.547 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.437 ' HG3' ' HB2' ' A' ' 51' ' ' ASP . 6.1 mt-10 -79.46 -27.17 41.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.699 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.802 HD22 ' HG3' ' A' ' 26' ' ' GLU . 0.7 OUTLIER -59.47 -46.73 87.97 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.084 0.469 . . . . 0.0 109.925 179.123 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.486 ' O ' ' HG3' ' A' ' 60' ' ' GLU . 1.0 OUTLIER -61.2 -44.93 96.49 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.653 179.403 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 25.7 t60 -57.08 -40.33 76.7 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.055 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.711 ' HE2' ' HA ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -58.91 -42.39 89.51 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.645 179.184 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 9.0 tt -63.8 -24.53 67.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.063 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.486 ' HG3' ' O ' ' A' ' 56' ' ' LEU . 17.4 mt-10 -105.3 2.89 29.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.338 -178.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.554 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 43.6 m -122.66 78.24 47.66 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.675 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.438 ' O ' ' HB2' ' A' ' 66' ' ' ARG . 18.7 Cg_endo -57.84 -34.94 98.94 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.339 2.026 . . . . 0.0 112.099 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -78.39 -46.96 18.63 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.728 -179.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.519 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 12.8 m -72.91 -53.39 11.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.648 -177.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.711 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 0.1 OUTLIER -57.82 -58.9 6.34 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.264 -178.387 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -50.94 -36.24 37.61 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.859 -0.337 . . . . 0.0 111.102 -178.246 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.4 m -69.39 -36.25 76.58 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.071 0.462 . . . . 0.0 110.292 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.435 ' HG3' HD23 ' B' ' 6' ' ' LEU . 5.5 ttpt -65.77 -56.26 12.89 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.263 178.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.737 HG13 HG12 ' A' ' 32' ' ' ILE . 30.2 t -64.85 -21.23 28.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.36 178.537 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.415 ' HB2' ' O ' ' A' ' 66' ' ' ARG . 13.7 t70 -53.45 -48.03 69.18 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 177.295 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.83 -32.92 72.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.767 176.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.762 ' HA ' HG11 ' A' ' 75' ' ' VAL . . . -55.69 -42.44 75.2 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.163 177.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.642 ' HA ' HD12 ' A' ' 43' ' ' ILE . 24.4 t -60.82 -31.65 50.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 176.647 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.46 -36.41 65.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.604 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.762 HG11 ' HA ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -57.73 -28.22 31.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.895 0.379 . . . . 0.0 110.092 179.79 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.747 HD22 HG12 ' A' ' 43' ' ' ILE . 3.0 mm? -71.62 -54.31 10.83 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.534 178.358 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -51.12 -34.63 31.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.439 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.5 -30.91 33.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.828 178.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 12.5 t-160 . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.083 -179.762 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.641 0.258 . . . . 0.0 111.078 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.816 ' HB2' HD12 ' A' ' 47' ' ' LEU . 16.6 mt -64.85 -87.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.774 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' ASN . . . . . 0.562 HD21 ' H ' ' B' ' 9' ' ' ASN . 0.5 OUTLIER -74.46 124.97 90.19 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.708 179.212 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -79.07 3.82 7.08 Favored 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.18 1.92 . . . . 0.0 112.111 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 9' ' ' ASN . . . . . 0.562 ' H ' HD21 ' B' ' 7' ' ' ASN . 32.8 m-80 -123.53 44.5 2.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.902 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.57 98.13 0.06 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.494 179.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.482 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.1 OUTLIER -122.24 -179.51 4.2 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.634 178.848 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -68.46 172.29 6.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.82 179.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' PHE . . . . . 0.565 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.1 t80 . . . . . 0 C--N 1.331 -0.204 0 CA-C-O 120.974 0.416 . . . . 0.0 110.93 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.626 ' HG2' HE22 ' A' ' 20' ' ' GLN . 9.1 mttt . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.907 0.384 . . . . 0.0 110.788 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . 0.514 ' HD2' ' HB3' ' A' ' 48' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.902 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.791 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 3.6 t . . . . . 0 N--CA 1.456 -0.171 0 CA-C-O 120.695 0.283 . . . . 0.0 110.273 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.414 ' N ' HG23 ' A' ' 8' ' ' THR . . . -59.37 -35.43 73.9 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 176.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.7 t -71.08 -36.19 72.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.623 177.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.791 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.3 mtm -64.23 -34.4 78.01 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.896 177.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.631 HD13 ' SD ' ' A' ' 23' ' ' MET . 1.2 mp -52.74 -52.61 55.68 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.843 178.351 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.02 -26.99 67.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.915 178.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.7 p -101.5 21.23 14.61 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.74 -178.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.777 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 CA--C 1.534 0.358 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.208 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.777 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 1.7 tp10 . . . . . 0 N--CA 1.456 -0.148 0 CA-C-O 120.88 0.371 . . . . 0.0 110.373 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.436 HE22 ' HG2' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -51.53 -68.29 0.18 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.628 -179.082 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.545 ' HE2' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.4 -18.49 6.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.371 -178.066 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.638 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 5.4 tp60 -73.6 -79.82 0.08 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.901 0.381 . . . . 0.0 111.336 178.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' MET . . . . . 0.68 ' HA ' ' HE2' ' A' ' 11' ' ' MET . 0.0 OUTLIER -69.57 -96.09 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 N-CA-C 112.616 0.599 . . . . 0.0 112.616 -177.08 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.67 HD13 HH11 ' A' ' 27' ' ' ARG . 0.3 OUTLIER -61.04 0.43 0.23 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.059 0.762 . . . . 0.0 113.059 -176.064 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.6 ' O ' HD22 ' A' ' 24' ' ' LEU . . . 64.4 -118.12 12.1 Favored Glycine 0 N--CA 1.446 -0.655 0 N-CA-C 108.332 -1.907 . . . . 0.0 108.332 -175.011 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.491 ' HG3' HD22 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -75.98 -67.65 0.66 Allowed 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 168.71 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.742 ' HG3' HD22 ' A' ' 31' ' ' LEU . 5.2 tpt180 -160.16 12.0 0.12 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.385 -1.28 . . . . 0.0 108.442 175.373 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.667 ' HA ' HD13 ' A' ' 31' ' ' LEU . 4.2 mm? -57.82 -80.44 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.846 -1.07 . . . . 0.0 113.713 -174.16 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.644 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -33.46 -50.16 0.74 Allowed Pre-proline 0 CA--C 1.537 0.446 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -175.223 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.59 ' HG2' ' O ' ' A' ' 27' ' ' ARG . 12.7 Cg_endo -59.16 -42.15 53.4 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.204 1.936 . . . . 0.0 113.521 -177.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.742 HD22 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.09 -45.76 63.08 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 120.144 -0.622 . . . . 0.0 110.151 -179.147 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.63 HD12 ' HB ' ' A' ' 43' ' ' ILE . 0.3 OUTLIER -74.7 -12.36 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.998 178.142 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.637 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 60.3 tp60 -62.13 -39.29 92.08 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 176.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.0 -31.66 71.52 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.298 -0.864 . . . . 0.0 109.076 174.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' MET . . . . . 0.51 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 7.1 mtt -100.54 28.13 5.31 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.225 178.014 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.637 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.2 OUTLIER -64.09 -31.95 6.88 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 -177.267 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.536 ' CD ' ' N ' ' A' ' 36' ' ' HIS . 63.0 Cg_exo -37.68 -30.51 0.14 Allowed 'Trans proline' 0 C--N 1.361 1.236 0 C-N-CA 122.047 1.831 . . . . 0.0 112.159 179.055 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.811 HG23 HG12 ' A' ' 73' ' ' VAL . 0.2 OUTLIER -78.16 -89.11 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.737 176.578 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.509 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.1 OUTLIER -171.24 58.4 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.92 177.718 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.486 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -43.47 -35.4 1.61 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.743 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.644 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.16 -57.42 8.02 Favored Glycine 0 C--O 1.229 -0.216 0 CA-C-N 115.961 -0.563 . . . . 0.0 114.098 -178.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.608 ' HG3' ' HE3' ' A' ' 46' ' ' MET . 1.6 tptm -79.03 -39.01 35.11 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 117.085 0.442 . . . . 0.0 112.15 -178.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.63 ' HB ' HD12 ' A' ' 32' ' ' ILE . 17.2 mt -53.09 -48.62 53.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 C-N-CA 121.155 -0.218 . . . . 0.0 111.426 -177.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.506 HG23 ' O ' ' A' ' 41' ' ' GLY . 5.1 t -47.86 -48.04 31.33 Favored 'General case' 0 CA--C 1.521 -0.17 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 178.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.554 ' CA ' ' HB2' ' B' ' 13' ' ' PHE . . . -56.67 -53.25 45.17 Favored Glycine 0 N--CA 1.449 -0.458 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.871 179.212 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.608 ' HE3' ' HG3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.33 -56.43 20.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.794 0.33 . . . . 0.0 110.982 -179.112 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.707 HD12 ' HB2' ' B' ' 7' ' ' ASN . 2.9 mm? -80.28 7.76 8.83 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.397 -179.247 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.477 HD23 ' O ' ' A' ' 44' ' ' THR . 0.0 OUTLIER -65.46 -20.9 66.55 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.791 0.329 . . . . 0.0 110.748 179.897 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.484 ' HG3' ' O ' ' B' ' 9' ' ' ASN . 3.6 mt-10 -75.71 20.27 0.18 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.888 179.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.491 HD13 ' HE3' ' A' ' 68' ' ' LYS . 2.7 tt -83.58 169.07 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.905 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.439 ' HB2' ' HG3' ' A' ' 54' ' ' GLU . 2.6 m-20 -71.03 155.93 40.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.951 0.405 . . . . 0.0 111.427 -179.626 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.486 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 4.2 m120 -88.06 -28.46 21.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.643 177.238 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.96 -30.67 62.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.608 177.125 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.578 ' O ' ' HG2' ' A' ' 58' ' ' MET . 4.0 mt-10 -77.26 -29.41 53.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.49 178.776 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.497 ' CD1' ' HB2' ' A' ' 27' ' ' ARG . 0.6 OUTLIER -58.79 -46.1 88.36 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.209 -179.901 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.405 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 7.6 tp -60.75 -47.38 86.56 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.558 178.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -65.72 -20.07 66.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.375 -179.644 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.636 ' SD ' ' HA ' ' A' ' 65' ' ' LEU . 25.3 mmt -69.65 -54.57 13.28 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.054 -179.708 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.589 HD21 ' NE ' ' A' ' 27' ' ' ARG . 0.1 OUTLIER -63.27 -17.87 62.96 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.893 0.377 . . . . 0.0 110.685 179.479 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.481 ' O ' ' HG3' ' A' ' 60' ' ' GLU . 0.0 OUTLIER -94.73 -13.26 25.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.788 -179.856 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.587 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.5 OUTLIER -122.3 87.66 48.44 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.189 -179.872 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -59.31 -32.22 96.41 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.268 1.979 . . . . 0.0 112.129 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -77.78 -49.77 13.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.618 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.421 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 75.5 m -69.16 -46.34 67.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.185 -178.469 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.636 ' HA ' ' SD ' ' A' ' 58' ' ' MET . 1.2 tp -60.17 -64.74 0.84 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.814 -178.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.559 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -49.54 -28.83 5.98 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.875 -177.933 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.469 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 9.2 t -62.32 -45.32 93.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.181 177.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.534 ' HG2' HD11 ' B' ' 6' ' ' LEU . 14.2 mtmm -66.45 -62.05 1.67 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.921 179.355 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.704 ' HA ' ' HB3' ' A' ' 72' ' ' ALA . 73.2 t -57.75 -20.72 14.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.756 -179.321 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.469 ' HB3' ' O ' ' A' ' 67' ' ' SER . 10.0 t70 -57.26 -49.22 76.74 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 175.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -67.18 -27.76 67.54 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.547 175.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.704 ' HB3' ' HA ' ' A' ' 69' ' ' VAL . . . -66.1 -36.68 83.83 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.586 178.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.811 HG12 HG23 ' A' ' 38' ' ' THR . 5.1 t -59.94 -32.85 50.94 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.184 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 176.23 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.69 -34.18 64.76 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.824 175.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.578 ' HB ' ' O ' ' A' ' 72' ' ' ALA . 15.7 t -55.03 -33.07 28.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.919 178.205 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.63 ' HB2' HG12 ' A' ' 43' ' ' ILE . 3.1 tm? -71.36 -47.08 58.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.173 177.581 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 32.6 mm-40 -63.87 -24.05 67.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.048 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.8 -24.94 38.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.834 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 26.1 t-80 . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.861 179.785 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 9.1 m120 . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.65 0.262 . . . . 0.0 110.943 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.645 ' HB3' HD13 ' A' ' 47' ' ' LEU . 27.1 tp -71.92 -83.68 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.381 179.318 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' ASN . . . . . 0.707 ' HB2' HD12 ' A' ' 47' ' ' LEU . 1.9 t30 -82.81 129.15 63.08 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.267 178.151 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 7.1 Cg_exo -73.94 4.25 4.35 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.187 1.924 . . . . 0.0 111.997 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 9' ' ' ASN . . . . . 0.484 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 18.5 m120 -123.63 37.42 4.42 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.308 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . 0.53 ' HA ' ' O ' ' A' ' 46' ' ' MET . . . -60.43 87.5 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.087 179.263 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.441 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 1.5 mmtp -116.21 177.86 4.53 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.964 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . 0.516 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -68.21 158.76 32.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.72 0.295 . . . . 0.0 111.065 179.76 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' PHE . . . . . 0.554 ' HB2' ' CA ' ' A' ' 45' ' ' GLY . 1.1 t80 . . . . . 0 C--N 1.332 -0.166 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.857 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.436 ' HG2' HE22 ' A' ' 20' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.782 0.325 . . . . 0.0 110.672 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.331 -0.237 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.943 -179.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.828 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 12.7 t . . . . . 0 N--CA 1.455 -0.225 0 CA-C-O 120.742 0.306 . . . . 0.0 110.236 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.61 -41.01 89.41 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 176.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 7.5 t -67.44 -33.79 75.88 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.508 176.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.828 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.1 mtm -64.25 -37.24 86.79 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.182 177.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.81 HD22 ' HB3' ' A' ' 24' ' ' LEU . 22.9 mt -54.28 -45.99 72.62 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.547 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.8 -36.3 82.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.102 178.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -101.16 46.55 0.94 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.047 -179.655 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.673 ' O ' ' HB2' ' A' ' 19' ' ' GLU . . . . . . . . 0 CA--C 1.536 0.437 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 -178.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.673 ' HB2' ' O ' ' A' ' 15' ' ' ALA . 1.1 tp10 . . . . . 0 N--CA 1.46 0.03 0 CA-C-O 120.64 0.257 . . . . 0.0 110.876 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.613 HE22 ' HG2' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -47.0 -56.7 5.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.605 -178.853 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.614 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -56.07 -22.34 27.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.648 -178.359 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.614 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 5.4 tp60 -73.46 -79.91 0.08 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.915 0.388 . . . . 0.0 111.677 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' MET . . . . . 0.56 ' HE1' ' HA ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.76 -96.22 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -176.47 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.81 ' HB3' HD22 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -59.26 -2.45 0.29 Allowed 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 113.647 0.98 . . . . 0.0 113.647 -175.359 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.596 ' O ' HD22 ' A' ' 24' ' ' LEU . . . 64.48 -116.78 9.45 Favored Glycine 0 N--CA 1.448 -0.549 0 N-CA-C 108.374 -1.891 . . . . 0.0 108.374 -174.621 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.576 ' HG3' HD21 ' A' ' 55' ' ' LEU . 0.8 OUTLIER -76.23 -69.14 0.52 Allowed 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 168.269 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.65 ' NE ' HD13 ' A' ' 59' ' ' LEU . 0.2 OUTLIER -159.82 13.1 0.13 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.163 -1.381 . . . . 0.0 108.178 174.56 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.578 HD12 ' HB2' ' A' ' 47' ' ' LEU . 4.1 mm? -57.64 -78.57 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.662 -1.153 . . . . 0.0 113.439 -174.379 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.602 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -37.42 -48.88 2.47 Favored Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 -174.799 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.576 ' HG3' ' HB2' ' A' ' 24' ' ' LEU . 12.6 Cg_endo -58.69 -43.29 45.82 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 122.14 1.893 . . . . 0.0 113.621 -177.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.577 ' HG ' ' O ' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.19 -46.69 60.74 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 120.111 -0.636 . . . . 0.0 110.289 -178.719 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.562 HG21 HD12 ' A' ' 43' ' ' ILE . 0.4 OUTLIER -73.28 -12.47 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 CA-C-N 116.208 -0.451 . . . . 0.0 109.969 178.224 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.602 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 47.7 tp60 -62.14 -40.54 96.3 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 176.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.62 -29.98 69.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.08 174.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' MET . . . . . 0.57 ' SD ' HG11 ' A' ' 69' ' ' VAL . 6.7 mtt -101.65 27.17 6.61 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.394 178.428 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.602 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -63.66 -32.08 7.49 Favored Pre-proline 0 CA--C 1.537 0.445 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -177.594 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.555 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 50.5 Cg_exo -35.97 -32.55 0.1 Allowed 'Trans proline' 0 C--N 1.363 1.342 0 C-N-CA 122.178 1.919 . . . . 0.0 112.034 178.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.798 HG23 HG12 ' A' ' 73' ' ' VAL . 7.2 m -78.14 -88.58 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.512 176.014 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.508 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.3 OUTLIER -171.59 62.73 0.03 OUTLIER 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.196 177.552 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.464 ' HB3' ' HB ' ' A' ' 32' ' ' ILE . . . -46.67 -34.72 5.32 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.662 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.602 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -52.88 -53.94 30.93 Favored Glycine 0 C--N 1.33 0.239 0 C-N-CA 121.17 -0.538 . . . . 0.0 113.81 -178.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.474 ' HD2' ' HG2' ' B' ' 12' ' ' GLU . 0.0 OUTLIER -78.11 -39.0 42.7 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.887 0.343 . . . . 0.0 111.797 -178.387 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.627 HD11 ' HA ' ' A' ' 73' ' ' VAL . 31.8 mt -53.95 -54.14 22.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.038 -179.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.563 HG23 ' CD2' ' A' ' 29' ' ' PHE . 6.4 t -50.17 -45.69 53.58 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 120.889 0.376 . . . . 0.0 110.121 178.003 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.542 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -50.83 -67.46 1.92 Allowed Glycine 0 N--CA 1.451 -0.317 0 CA-C-N 115.606 -0.724 . . . . 0.0 113.235 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.547 ' HE3' HG22 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -56.05 -46.06 79.05 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 -178.031 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.578 ' HB2' HD12 ' A' ' 28' ' ' LEU . 3.3 mm? -80.11 3.09 21.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.719 -0.219 . . . . 0.0 111.588 -178.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.55 ' HG ' ' CE1' ' B' ' 13' ' ' PHE . 0.0 OUTLIER -65.96 -8.24 21.51 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.938 0.399 . . . . 0.0 110.54 179.253 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.449 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 1.4 mm-40 -83.47 18.36 1.87 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.373 178.433 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 1.5 tt -83.27 163.85 2.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.96 -179.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.422 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 3.4 m-20 -70.81 157.56 37.88 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.564 -179.124 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.679 ' HA ' HD21 ' A' ' 55' ' ' LEU . 4.6 m120 -86.61 -28.83 23.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.969 177.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 8.7 m -73.9 -32.09 63.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.644 177.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -75.98 -29.5 58.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.554 178.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.679 HD21 ' HA ' ' A' ' 52' ' ' ASN . 0.5 OUTLIER -59.45 -47.74 84.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.504 -179.766 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.438 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 52.4 tp -61.7 -40.72 96.02 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.712 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -66.02 -30.95 71.58 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.164 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.48 -54.85 22.38 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.897 -179.601 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.65 HD13 ' NE ' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -66.1 -13.08 59.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.115 0.483 . . . . 0.0 110.123 178.76 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.508 ' O ' ' HG3' ' A' ' 60' ' ' GLU . 2.3 tp10 -95.46 -12.92 25.07 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.631 177.537 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.539 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 4.1 m -122.57 79.58 47.21 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.732 179.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -54.58 -34.21 81.87 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.398 2.065 . . . . 0.0 112.206 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -77.95 -49.72 13.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.552 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.439 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 3.7 m -71.23 -23.12 61.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.904 0.383 . . . . 0.0 111.4 -178.607 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.539 ' HB3' ' O ' ' A' ' 61' ' ' SER . 1.7 tp -78.54 -64.87 1.07 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.639 -178.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.539 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 1.5 ttm180 -51.43 -29.27 15.41 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.849 -178.104 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.544 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 3.3 t -69.67 -40.84 76.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.301 0.572 . . . . 0.0 110.005 177.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.402 ' O ' HD13 ' B' ' 6' ' ' LEU . 21.4 ttpt -65.74 -59.69 3.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.203 178.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.714 ' HA ' ' HB3' ' A' ' 72' ' ' ALA . 54.1 t -62.47 -19.89 23.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.637 179.222 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.544 ' HB3' ' O ' ' A' ' 67' ' ' SER . 17.1 t70 -54.07 -48.99 70.05 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 176.531 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -66.77 -32.9 74.5 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.658 176.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.714 ' HB3' ' HA ' ' A' ' 69' ' ' VAL . . . -58.19 -38.11 76.09 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.525 178.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.798 HG12 HG23 ' A' ' 38' ' ' THR . 8.0 t -65.26 -31.4 53.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.61 177.421 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.1 -37.08 69.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.146 179.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.562 HG11 ' HB2' ' B' ' 5' ' ' ASN . 0.9 OUTLIER -57.61 -31.71 40.2 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.115 0 CA-C-O 121.168 0.508 . . . . 0.0 109.955 178.989 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.498 ' N ' HG23 ' A' ' 75' ' ' VAL . 2.8 tm? -71.24 -49.91 38.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.39 179.061 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -54.94 -37.33 66.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.664 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.15 -24.28 37.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.811 179.133 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.408 ' HB2' ' O ' ' A' ' 75' ' ' VAL . 6.6 t60 . . . . . 0 C--N 1.33 -0.243 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.816 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 5' ' ' ASN . . . . . 0.562 ' HB2' HG11 ' A' ' 75' ' ' VAL . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.735 0.303 . . . . 0.0 110.881 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.402 HD13 ' O ' ' A' ' 68' ' ' LYS . 5.6 mt -62.81 -85.32 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.808 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 7' ' ' ASN . . . . . 0.433 ' HA ' ' HD3' ' B' ' 8' ' ' PRO . 2.7 t30 -75.85 130.05 79.63 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.866 179.538 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 6.6 Cg_exo -73.28 -3.41 13.63 Favored 'Trans proline' 0 N--CA 1.46 -0.475 0 C-N-CA 122.368 2.045 . . . . 0.0 111.625 178.654 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 9' ' ' ASN . . . . . 0.666 ' HB3' ' HZ3' ' B' ' 11' ' ' LYS . 7.9 m120 -123.48 51.97 1.45 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.636 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.86 95.67 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.756 -179.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.666 ' HZ3' ' HB3' ' B' ' 9' ' ' ASN . 9.6 mttp -121.57 121.69 37.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.027 178.072 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . 0.474 ' HG2' ' HD2' ' A' ' 42' ' ' LYS . 6.0 mt-10 -49.68 176.87 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.315 0.579 . . . . 0.0 112.366 -177.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' PHE . . . . . 0.55 ' CE1' ' HG ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.519 -0.213 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.248 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.613 ' HG2' HE22 ' A' ' 20' ' ' GLN . 9.0 mttt . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.925 0.393 . . . . 0.0 110.625 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . 0.436 ' HB3' ' O ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.0 -179.222 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.719 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 3.0 t . . . . . 0 CA--C 1.521 -0.136 0 CA-C-O 120.513 0.197 . . . . 0.0 110.717 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.441 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.18 -36.1 74.74 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 177.406 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.8 t -70.21 -34.81 73.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.729 177.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.719 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 4.1 mtm -64.36 -35.34 80.56 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.823 177.633 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.775 HD12 ' HB3' ' A' ' 24' ' ' LEU . 3.8 mp -52.47 -51.21 60.49 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.994 178.769 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.96 -26.92 67.79 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.778 178.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.7 15.85 27.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.688 -178.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.578 ' HB3' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 CA--C 1.534 0.335 0 CA-C-O 120.546 0.212 . . . . 0.0 111.272 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.578 ' HB3' ' HB3' ' A' ' 15' ' ' ALA . 1.3 tp10 . . . . . 0 N--CA 1.454 -0.27 0 CA-C-O 120.737 0.303 . . . . 0.0 110.782 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.535 HE22 ' HG2' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -47.72 -62.17 1.58 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.424 -178.423 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.635 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.73 -20.92 16.3 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.895 -177.049 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.635 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 23.5 tt0 -73.81 -80.3 0.08 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.013 0.435 . . . . 0.0 111.683 179.309 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' MET . . . . . 0.604 ' HA ' ' HE3' ' A' ' 11' ' ' MET . 0.0 OUTLIER -70.16 -96.84 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.04 0.755 . . . . 0.0 113.04 -176.453 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.775 ' HB3' HD12 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -57.69 0.83 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -175.422 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.502 ' O ' HD23 ' A' ' 24' ' ' LEU . . . 64.86 -118.06 11.63 Favored Glycine 0 N--CA 1.446 -0.681 0 N-CA-C 108.349 -1.901 . . . . 0.0 108.349 -174.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.482 ' HG3' ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -76.07 -67.31 0.69 Allowed 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 168.713 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.843 ' HG3' HD23 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -160.09 8.12 0.1 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.262 -1.335 . . . . 0.0 108.142 175.278 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.787 HD23 ' HA ' ' A' ' 44' ' ' THR . 0.3 OUTLIER -59.28 -78.21 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.305 -1.316 . . . . 0.0 113.942 -173.656 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.62 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -33.67 -48.88 0.75 Allowed Pre-proline 0 CA--C 1.535 0.397 0 N-CA-C 113.758 1.022 . . . . 0.0 113.758 -175.147 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.604 ' HG3' ' HB2' ' A' ' 24' ' ' LEU . 18.9 Cg_endo -61.01 -42.86 33.63 Favored 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 122.137 1.891 . . . . 0.0 113.291 -178.052 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.843 HD23 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.36 -44.9 64.13 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 119.956 -0.698 . . . . 0.0 110.153 -179.566 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.63 HG12 HG12 ' A' ' 69' ' ' VAL . 0.5 OUTLIER -73.05 -14.46 16.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 CA-C-N 116.233 -0.44 . . . . 0.0 109.891 178.018 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.643 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 4.4 tp-100 -62.41 -38.69 90.64 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 176.489 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.42 -30.12 69.79 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.327 -0.851 . . . . 0.0 108.939 174.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' MET . . . . . 0.616 ' SD ' HG11 ' A' ' 69' ' ' VAL . 6.8 mtt -102.18 26.28 7.87 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.209 177.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.643 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.9 p-80 -64.59 -32.08 6.57 Favored Pre-proline 0 CA--C 1.536 0.41 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 -177.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.562 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 44.4 Cg_exo -35.1 -34.06 0.1 OUTLIER 'Trans proline' 0 C--N 1.363 1.317 0 C-N-CA 122.24 1.96 . . . . 0.0 112.319 178.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 52.6 m -78.52 -87.61 0.06 Allowed 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.678 176.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.555 ' HB2' HD13 ' A' ' 76' ' ' LEU . 0.1 OUTLIER -171.47 63.78 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.49 178.102 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.487 ' HB1' ' O ' ' A' ' 32' ' ' ILE . . . -47.96 -34.69 9.56 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 120.873 0.368 . . . . 0.0 111.622 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.62 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -51.5 -56.93 13.16 Favored Glycine 0 CA--C 1.518 0.23 0 CA-C-N 115.948 -0.569 . . . . 0.0 114.034 -178.379 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.59 ' HE2' ' SD ' ' A' ' 46' ' ' MET . 2.5 tptm -75.6 -35.65 60.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 117.034 0.417 . . . . 0.0 111.686 -177.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.755 HD11 ' HA ' ' A' ' 73' ' ' VAL . 41.2 mt -54.02 -59.48 2.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.139 -179.37 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.787 ' HA ' HD23 ' A' ' 28' ' ' LEU . 11.0 t -47.82 -43.12 27.71 Favored 'General case' 0 CA--C 1.522 -0.129 0 CA-C-O 120.85 0.357 . . . . 0.0 110.444 178.863 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.685 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -48.23 -71.79 0.53 Allowed Glycine 0 N--CA 1.45 -0.396 0 CA-C-N 115.738 -0.665 . . . . 0.0 113.232 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.59 ' SD ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.7 -43.41 76.44 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 117.035 0.417 . . . . 0.0 111.723 -178.399 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.651 HD11 ' HB3' ' B' ' 6' ' ' LEU . 3.1 mm? -79.84 5.64 13.15 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.682 0.253 . . . . 0.0 111.682 -178.517 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.62 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.17 -12.02 53.23 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.868 0.366 . . . . 0.0 110.605 179.627 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.43 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.1 mm-40 -78.0 17.65 0.57 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.364 177.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.442 ' H ' ' C ' ' A' ' 48' ' ' LEU . 0.9 OUTLIER -83.45 159.46 3.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.1 -179.398 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.599 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 3.9 m-20 -71.01 151.1 44.96 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -178.064 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.503 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 2.2 t-20 -80.52 -30.51 37.19 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.679 177.016 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 39.6 m -73.99 -31.87 63.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.662 177.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.599 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 0.9 OUTLIER -76.55 -27.87 56.08 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.536 178.746 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.532 ' CD1' ' HB2' ' A' ' 27' ' ' ARG . 0.6 OUTLIER -59.39 -48.73 80.51 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.355 179.841 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.483 ' HA ' HD22 ' A' ' 56' ' ' LEU . 0.9 OUTLIER -60.7 -43.61 97.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.551 179.614 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -59.59 -32.57 70.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.22 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.471 ' HE1' ' HE2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -65.94 -45.41 81.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.324 -179.408 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.592 HD22 ' NE ' ' A' ' 27' ' ' ARG . 0.2 OUTLIER -67.15 -16.19 64.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.261 -179.524 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -98.79 -11.13 22.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.869 0.366 . . . . 0.0 110.915 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.579 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -123.68 86.48 52.85 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.864 179.859 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -60.35 -33.37 94.41 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.368 2.045 . . . . 0.0 112.216 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.603 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -77.98 -44.99 25.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.193 -179.723 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.603 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 14.5 m -73.83 -25.97 60.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.934 0.397 . . . . 0.0 111.051 -179.521 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.605 HD12 HD22 ' A' ' 31' ' ' LEU . 1.9 tp -78.76 -65.69 0.96 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.621 -178.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.575 ' HE ' ' HE3' ' A' ' 35' ' ' MET . 0.1 OUTLIER -51.4 -28.09 11.79 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.973 -178.0 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.561 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 28.7 t -69.42 -42.68 74.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.149 0.499 . . . . 0.0 110.094 178.129 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.505 ' O ' HD23 ' B' ' 6' ' ' LEU . 2.5 ttmm -66.08 -57.22 8.2 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.55 179.278 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.712 ' HA ' ' HB2' ' A' ' 72' ' ' ALA . 52.9 t -64.11 -18.73 23.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.636 179.289 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.582 ' O ' HG23 ' A' ' 73' ' ' VAL . 21.9 t70 -55.65 -49.95 71.52 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 176.552 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -68.53 -24.94 64.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.771 177.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.712 ' HB2' ' HA ' ' A' ' 69' ' ' VAL . . . -63.26 -50.58 69.62 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.191 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.755 ' HA ' HD11 ' A' ' 43' ' ' ILE . 3.7 m -58.15 -29.19 36.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 178.178 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.09 -36.75 75.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.083 179.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.68 HG11 ' HA ' ' A' ' 72' ' ' ALA . 1.3 m -59.67 -31.92 48.16 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.123 0 CA-C-O 121.078 0.466 . . . . 0.0 110.016 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.602 ' N ' HG23 ' A' ' 75' ' ' VAL . 2.4 tm? -71.91 -49.85 34.29 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.317 178.228 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 48.0 mm-40 -54.44 -39.82 67.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.51 179.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.48 -19.62 41.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.095 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.427 ' HB2' ' O ' ' A' ' 75' ' ' VAL . 4.0 t60 . . . . . 0 C--N 1.331 -0.209 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.016 -179.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 7.3 m120 . . . . . 0 C--O 1.233 0.2 0 CA-C-O 120.738 0.304 . . . . 0.0 111.291 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.651 ' HB3' HD11 ' A' ' 47' ' ' LEU . 6.0 tp -62.43 -82.44 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.612 -179.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 7' ' ' ASN . . . . . 0.503 ' HB2' ' CD1' ' A' ' 47' ' ' LEU . 2.3 t30 -75.22 136.46 72.42 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.651 178.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.72 -10.72 18.49 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 122.117 1.878 . . . . 0.0 111.819 178.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 9' ' ' ASN . . . . . 0.517 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 4.0 m120 -123.93 63.25 1.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.769 179.777 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . 0.421 ' HB3' ' HB3' ' A' ' 46' ' ' MET . . . -60.15 92.06 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.561 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.517 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.2 OUTLIER -118.66 123.64 45.43 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.284 178.592 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . 0.556 ' HG2' ' HZ2' ' A' ' 42' ' ' LYS . 8.5 mt-10 -47.97 172.14 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.251 0.548 . . . . 0.0 112.366 -178.149 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' PHE . . . . . 0.685 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.5 OUTLIER . . . . . 0 C--N 1.332 -0.156 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.799 179.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.535 ' HG2' HE22 ' A' ' 20' ' ' GLN . 4.3 mtmp? . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.879 0.371 . . . . 0.0 110.985 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 1.2 t80 . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.049 -179.648 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.735 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 4.8 t . . . . . 0 N--CA 1.456 -0.173 0 CA-C-O 120.541 0.21 . . . . 0.0 110.552 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.635 ' HB3' HE22 ' A' ' 33' ' ' GLN . . . -59.45 -39.02 82.26 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 177.167 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.14 -34.83 73.54 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.651 177.221 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.735 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 3.2 mtm -64.46 -34.78 78.99 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.765 177.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.594 HD22 HH12 ' A' ' 27' ' ' ARG . 1.9 mp -52.58 -52.18 56.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.111 178.631 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.88 -26.25 67.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.781 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -101.83 15.78 27.93 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.699 -179.005 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.715 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 CA--C 1.532 0.276 0 CA-C-N 116.71 -0.223 . . . . 0.0 111.446 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.715 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 2.1 tp10 . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 120.822 0.344 . . . . 0.0 110.817 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.591 HE22 ' HG2' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -53.47 -62.79 1.42 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.356 -179.468 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.411 ' H ' ' HG3' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -55.63 -20.68 14.67 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.361 -178.079 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.659 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 0.8 OUTLIER -73.94 -78.63 0.09 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.04 0.448 . . . . 0.0 111.37 178.636 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' MET . . . . . 0.689 ' HA ' ' HE2' ' A' ' 11' ' ' MET . 0.0 OUTLIER -69.24 -96.35 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -176.665 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.607 ' HG ' ' HA ' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -61.4 1.52 0.2 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -175.038 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.546 ' O ' HD22 ' A' ' 24' ' ' LEU . . . 65.08 -117.18 9.86 Favored Glycine 0 N--CA 1.444 -0.794 0 N-CA-C 108.344 -1.903 . . . . 0.0 108.344 -174.3 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.552 ' HG3' HD23 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -75.9 -66.81 0.74 Allowed 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 169.345 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.607 ' HA ' ' HG ' ' A' ' 24' ' ' LEU . 22.1 tpt180 -160.36 5.51 0.08 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.273 -1.33 . . . . 0.0 107.89 176.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.691 ' HA ' HD13 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -59.28 -74.6 0.07 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.169 -1.378 . . . . 0.0 114.394 -172.554 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.587 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.2 OUTLIER -33.17 -49.1 0.64 Allowed Pre-proline 0 CA--C 1.542 0.639 0 N-CA-C 113.256 0.835 . . . . 0.0 113.256 -175.204 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.575 ' CD ' ' HB2' ' A' ' 24' ' ' LEU . 38.0 Cg_exo -61.82 -40.15 46.94 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 122.513 2.142 . . . . 0.0 113.669 -178.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.691 HD13 ' HA ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -70.13 -47.76 60.36 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 -179.347 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.796 HG12 HG11 ' A' ' 69' ' ' VAL . 0.5 OUTLIER -73.1 -13.2 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.637 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.878 177.478 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.652 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 45.7 tt0 -62.41 -41.04 98.38 Favored 'General case' 0 CA--C 1.518 -0.256 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 177.594 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.85 -29.97 70.02 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 175.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' MET . . . . . 0.593 ' SD ' HG13 ' A' ' 69' ' ' VAL . 4.7 mtt -101.75 26.19 7.72 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.23 178.191 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.652 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 3.2 p-80 -62.38 -32.76 10.07 Favored Pre-proline 0 CA--C 1.537 0.479 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -176.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.544 ' HD3' ' ND1' ' A' ' 36' ' ' HIS . 55.0 Cg_exo -36.43 -30.78 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.282 0 C-N-CA 122.151 1.901 . . . . 0.0 112.211 179.171 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.666 HG22 HG12 ' A' ' 73' ' ' VAL . 3.5 m -78.21 -89.13 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.73 176.474 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.515 HD13 ' H ' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -171.51 59.44 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.168 177.975 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.493 ' HB1' ' O ' ' A' ' 32' ' ' ILE . . . -43.57 -39.47 3.49 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.6 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.587 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.83 -56.49 9.83 Favored Glycine 0 C--N 1.329 0.186 0 CA-C-N 116.044 -0.525 . . . . 0.0 113.818 -179.186 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.631 ' HE2' ' SD ' ' A' ' 46' ' ' MET . 2.8 tptm -77.46 -37.48 51.36 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 -178.048 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.582 HD11 HG22 ' A' ' 32' ' ' ILE . 45.7 mt -53.74 -57.0 6.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.007 -178.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.637 ' HA ' HD23 ' A' ' 28' ' ' LEU . 9.8 t -49.25 -40.25 33.41 Favored 'General case' 0 N--CA 1.457 -0.115 0 CA-C-O 121.006 0.432 . . . . 0.0 110.073 177.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.742 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -50.33 -68.68 1.33 Allowed Glycine 0 N--CA 1.45 -0.426 0 CA-C-N 115.572 -0.74 . . . . 0.0 112.927 179.635 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.631 ' SD ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.19 -46.4 75.85 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -178.5 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.705 HD12 ' HB2' ' B' ' 7' ' ' ASN . 2.8 mm? -80.23 7.29 9.72 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 111.698 0.259 . . . . 0.0 111.698 -179.063 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.61 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.23 -13.24 60.03 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.9 0.381 . . . . 0.0 110.637 179.585 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.536 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 3.3 mt-10 -78.3 19.28 0.46 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.484 178.252 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.711 HD11 ' NZ ' ' A' ' 68' ' ' LYS . 2.3 tt -83.12 163.5 2.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.02 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.666 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 3.6 m-20 -71.12 158.95 35.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.731 -179.418 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.508 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 4.8 m120 -88.41 -29.08 20.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.837 -0.619 . . . . 0.0 109.676 176.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.91 -30.36 62.55 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 177.025 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.666 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 0.4 OUTLIER -76.93 -29.2 55.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.522 178.675 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.552 HD23 ' HG3' ' A' ' 26' ' ' GLU . 0.6 OUTLIER -59.32 -47.49 85.2 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.986 0.422 . . . . 0.0 110.364 179.777 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.425 ' HA ' HD22 ' A' ' 56' ' ' LEU . 1.3 tm? -60.7 -41.65 95.62 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.474 179.213 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.525 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 0.2 OUTLIER -61.69 -41.8 98.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.615 179.101 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.711 ' HE3' ' HD3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -62.09 -36.72 82.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.128 178.749 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.504 HD13 ' NE ' ' A' ' 27' ' ' ARG . 4.4 tt -71.09 -19.79 62.42 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.407 178.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.525 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 2.6 pt-20 -106.01 -2.46 22.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.148 -179.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.585 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 9.1 m -123.16 78.87 52.23 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.933 -179.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -55.79 -36.47 95.31 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.124 1.883 . . . . 0.0 112.059 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.443 ' HG2' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.7 -46.6 18.68 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.883 -179.065 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.585 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 14.1 m -71.15 -50.46 33.18 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.952 0.406 . . . . 0.0 111.311 -178.008 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.603 HD22 HD11 ' A' ' 31' ' ' LEU . 0.0 OUTLIER -57.95 -56.9 16.05 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.874 -179.242 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.543 ' N ' HD13 ' A' ' 65' ' ' LEU . 2.2 ttm180 -51.56 -30.78 22.03 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.744 -178.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.487 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 5.9 t -69.66 -38.54 77.14 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.031 0.444 . . . . 0.0 110.327 178.322 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.711 ' NZ ' HD11 ' A' ' 50' ' ' ILE . 8.7 mtpp -65.41 -58.55 5.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.189 178.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.796 HG11 HG12 ' A' ' 32' ' ' ILE . 49.5 t -62.75 -21.58 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.616 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.487 ' HB3' ' O ' ' A' ' 67' ' ' SER . 13.4 t0 -54.46 -48.97 71.14 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 177.089 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.42 ' OE1' HD13 ' B' ' 6' ' ' LEU . 21.6 tt0 -68.76 -32.62 72.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.602 176.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.785 ' HB3' ' HA ' ' A' ' 69' ' ' VAL . . . -58.29 -35.32 71.63 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.393 178.217 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.666 HG12 HG22 ' A' ' 38' ' ' THR . 25.3 t -67.0 -33.02 60.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.662 177.613 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.35 -38.01 71.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.123 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.774 HG12 ' HA ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -56.78 -33.38 40.81 Favored 'Isoleucine or valine' 0 C--O 1.231 0.092 0 CA-C-O 121.187 0.517 . . . . 0.0 109.916 179.17 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.473 ' HB2' HG12 ' A' ' 43' ' ' ILE . 2.9 tm? -69.37 -49.87 51.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.525 178.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -54.14 -35.44 62.23 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.601 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.0 -26.85 36.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.705 178.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 5.0 t60 . . . . . 0 C--N 1.332 -0.164 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.797 179.63 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 15.6 m120 . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.88 0.372 . . . . 0.0 110.702 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.42 HD13 ' OE1' ' A' ' 71' ' ' GLU . 3.3 tp -70.84 -83.23 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.601 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 7' ' ' ASN . . . . . 0.705 ' HB2' HD12 ' A' ' 47' ' ' LEU . 1.6 t30 -76.02 134.43 71.35 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.694 178.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -79.87 -8.32 14.46 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 122.327 2.018 . . . . 0.0 112.305 179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 9' ' ' ASN . . . . . 0.489 ' H ' HD21 ' B' ' 7' ' ' ASN . 73.9 m-20 -123.67 57.46 1.18 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.012 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.15 95.88 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.379 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.536 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -125.01 131.82 53.34 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.585 179.004 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -47.66 167.68 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 121.2 0.524 . . . . 0.0 112.301 -178.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' PHE . . . . . 0.742 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.6 OUTLIER . . . . . 0 C--N 1.332 -0.178 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.69 179.126 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.591 ' HG2' HE22 ' A' ' 20' ' ' GLN . 3.6 mttp . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.822 0.344 . . . . 0.0 110.84 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.841 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.772 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 5.2 t . . . . . 0 CA--C 1.52 -0.186 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.14 -37.07 76.37 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 176.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 17.3 t -70.1 -35.92 74.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.566 177.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.772 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 8.7 mtm -64.43 -35.52 81.19 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.129 177.732 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.626 ' HA ' ' HE1' ' A' ' 23' ' ' MET . 44.7 mt -52.71 -50.19 63.85 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.915 179.054 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.18 -28.83 69.06 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.875 177.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -101.76 23.92 10.63 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.931 -178.537 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.605 ' HB3' ' O ' ' A' ' 11' ' ' MET . . . . . . . . 0 C--N 1.33 -0.263 0 CA-C-O 120.626 0.251 . . . . 0.0 110.851 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.408 ' HA ' ' OE1' ' A' ' 19' ' ' GLU . 1.9 mm-40 . . . . . 0 N--CA 1.451 -0.421 0 CA-C-O 120.373 0.13 . . . . 0.0 111.086 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.543 ' O ' HD12 ' A' ' 24' ' ' LEU . 2.8 pp0? -46.9 -56.49 6.25 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.412 -177.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.438 ' HG2' ' NE2' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -56.15 -29.02 60.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.176 -179.163 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 14.9 tp60 -72.65 -73.86 0.19 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.483 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' MET . . . . . 0.626 ' HE1' ' HA ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.41 -97.87 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -176.926 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.722 HD22 ' HD3' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -62.22 3.65 0.17 Allowed 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -174.914 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.5 -118.7 13.22 Favored Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 108.274 -1.931 . . . . 0.0 108.274 -174.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.787 ' HG2' HG23 ' A' ' 50' ' ' ILE . 0.4 OUTLIER -75.59 -66.37 0.79 Allowed 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 106.962 -1.496 . . . . 0.0 106.962 168.105 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.722 ' HD3' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -159.81 5.99 0.09 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.009 -1.45 . . . . 0.0 108.0 174.164 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.601 HD23 ' HA ' ' A' ' 44' ' ' THR . 0.4 OUTLIER -59.64 -77.62 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.271 -1.331 . . . . 0.0 114.354 -173.061 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.512 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -33.15 -48.45 0.61 Allowed Pre-proline 0 CA--C 1.539 0.538 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -174.636 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.591 ' HD3' ' HA ' ' A' ' 24' ' ' LEU . 19.2 Cg_endo -62.13 -43.45 24.09 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.22 1.947 . . . . 0.0 113.448 -178.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.813 HD13 HG21 ' A' ' 69' ' ' VAL . 0.0 OUTLIER -71.32 -44.62 64.77 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 119.816 -0.754 . . . . 0.0 109.984 -179.645 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.6 HG22 HD11 ' A' ' 43' ' ' ILE . 0.5 OUTLIER -72.23 -13.34 16.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 177.689 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.641 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 57.7 tp60 -62.53 -41.75 99.07 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 176.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.83 -28.03 68.03 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 175.085 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' MET . . . . . 0.511 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 5.9 mtt -102.75 25.4 9.26 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.228 178.291 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.641 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 2.2 p-80 -64.39 -31.69 6.23 Favored Pre-proline 0 CA--C 1.536 0.421 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -176.526 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.541 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 51.8 Cg_exo -36.11 -31.74 0.1 OUTLIER 'Trans proline' 0 C--N 1.363 1.318 0 C-N-CA 122.125 1.884 . . . . 0.0 112.061 179.136 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.54 HG23 HG13 ' A' ' 73' ' ' VAL . 6.9 m -78.21 -88.92 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.578 176.144 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.598 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 7.7 tp -171.7 62.64 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.131 177.371 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.54 ' HB3' ' HB ' ' A' ' 32' ' ' ILE . . . -45.02 -41.2 7.22 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.544 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.512 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -52.17 -51.62 40.4 Favored Glycine 0 C--N 1.329 0.192 0 C-N-CA 121.172 -0.537 . . . . 0.0 113.587 -179.222 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.456 ' HA ' ' HD2' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -77.42 -40.44 43.49 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 122.719 -0.283 . . . . 0.0 111.68 -178.594 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.825 HD13 ' HA ' ' A' ' 73' ' ' VAL . 65.7 mt -53.7 -54.53 18.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.83 -179.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.601 ' HA ' HD23 ' A' ' 28' ' ' LEU . 11.4 t -53.47 -41.26 66.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.362 178.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.627 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -51.62 -67.45 1.99 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 121.009 -0.615 . . . . 0.0 112.85 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.666 ' HE3' HG22 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -55.35 -47.0 76.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.712 0.256 . . . . 0.0 111.575 -179.022 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.495 HD23 ' O ' ' A' ' 43' ' ' ILE . 3.1 mm? -80.28 8.23 7.85 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.625 0.231 . . . . 0.0 111.625 -179.216 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.627 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.1 OUTLIER -64.54 -13.26 51.81 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 121.017 0.437 . . . . 0.0 110.111 179.406 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.462 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.5 mt-10 -78.67 20.64 0.43 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.377 177.211 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.787 HG23 ' HG2' ' A' ' 26' ' ' GLU . 0.3 OUTLIER -83.26 157.03 3.79 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.672 -179.457 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.65 155.47 40.46 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.905 0.383 . . . . 0.0 111.745 -178.278 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.751 ' HA ' HD23 ' A' ' 55' ' ' LEU . 3.1 m120 -85.61 -28.98 24.45 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.06 177.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 62.6 m -74.19 -29.96 62.0 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.721 177.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.555 ' O ' ' HG2' ' A' ' 58' ' ' MET . 2.6 mm-40 -79.88 -29.39 39.96 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.638 179.062 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.751 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -58.99 -46.88 87.05 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.132 179.757 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.436 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 26.9 tp -62.16 -45.55 92.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.617 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -59.62 -28.49 67.26 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.17 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.628 ' SD ' ' HA ' ' A' ' 65' ' ' LEU . 32.1 mmt -69.51 -49.05 58.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.377 -179.375 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.656 HD23 ' NE ' ' A' ' 27' ' ' ARG . 0.2 OUTLIER -64.38 -21.23 66.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.092 -179.576 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -96.38 -4.56 41.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.062 0.458 . . . . 0.0 110.41 178.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.578 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 11.9 m -124.18 78.39 59.96 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.803 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -55.79 -33.73 88.99 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.138 1.892 . . . . 0.0 112.146 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -78.13 -49.44 13.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.828 -179.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.578 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 39.2 m -69.45 -45.38 69.21 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.853 0.359 . . . . 0.0 111.444 -178.272 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.64 ' HG ' ' N ' ' A' ' 66' ' ' ARG . 0.6 OUTLIER -57.92 -66.72 0.43 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.409 -178.835 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.64 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -47.06 -31.47 3.38 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.924 -178.884 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.513 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.5 OUTLIER -65.36 -44.27 88.18 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.164 0.507 . . . . 0.0 109.986 177.714 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.688 ' NZ ' HD13 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -65.86 -59.85 3.45 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.555 178.791 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.813 HG21 HD13 ' A' ' 31' ' ' LEU . 78.8 t -61.05 -19.67 20.46 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.018 179.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.513 ' HB3' ' O ' ' A' ' 67' ' ' SER . 7.1 t70 -55.7 -49.42 73.06 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 176.174 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.406 ' O ' HG12 ' A' ' 75' ' ' VAL . 22.2 tt0 -66.12 -32.53 74.03 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.677 176.239 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.758 ' HB2' ' HA ' ' A' ' 69' ' ' VAL . . . -57.74 -37.07 72.97 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.31 178.639 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.825 ' HA ' HD13 ' A' ' 43' ' ' ILE . 24.6 t -65.04 -32.57 58.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.642 177.465 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.05 -36.62 66.93 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.205 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.724 HG11 ' HA ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.85 -29.45 40.49 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.129 0 CA-C-O 121.02 0.438 . . . . 0.0 110.098 179.111 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.598 ' HG ' ' HB3' ' A' ' 39' ' ' LEU . 2.6 tm? -70.34 -51.01 33.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.375 178.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -58.06 -35.54 71.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.457 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.27 -17.91 47.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.006 179.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.966 -179.896 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 5' ' ' ASN . . . . . 0.427 ' HB2' HG13 ' A' ' 75' ' ' VAL . 2.6 m-80 . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.682 0.277 . . . . 0.0 110.914 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.517 HD23 ' HG2' ' A' ' 68' ' ' LYS . 3.4 mt -62.72 -80.18 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.583 179.572 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 7' ' ' ASN . . . . . 0.483 HD21 ' H ' ' B' ' 9' ' ' ASN . 2.7 t30 -75.02 142.34 75.95 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.556 178.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -78.98 -12.18 14.71 Favored 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.318 2.012 . . . . 0.0 112.122 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 9' ' ' ASN . . . . . 0.564 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 69.9 m-20 -123.96 60.72 1.11 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.163 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.86 96.11 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.616 179.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.583 ' HG3' ' HH ' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -122.47 129.05 51.61 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.37 178.433 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -48.17 173.44 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.115 0.483 . . . . 0.0 112.126 -178.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' PHE . . . . . 0.483 ' CE1' ' HG ' ' A' ' 48' ' ' LEU . 0.3 OUTLIER . . . . . 0 CA--C 1.519 -0.248 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.867 179.393 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.481 ' HG2' ' NE2' ' A' ' 20' ' ' GLN . 7.6 mttt . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.89 0.376 . . . . 0.0 110.63 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . 0.583 ' HH ' ' HG3' ' B' ' 11' ' ' LYS . 1.7 t80 . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.941 -179.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.85 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 10.8 t . . . . . 0 N--CA 1.457 -0.123 0 CA-C-O 120.647 0.26 . . . . 0.0 110.473 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.422 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.45 -37.2 77.55 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 176.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.3 t -70.56 -33.77 71.48 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.591 177.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.85 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.3 mtm -64.09 -35.74 81.75 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 177.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.652 HD11 ' SD ' ' A' ' 23' ' ' MET . 1.7 mp -52.32 -54.27 33.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.02 178.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.31 -26.68 67.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.244 178.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.7 p -101.64 15.57 28.51 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.881 -178.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.663 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.329 -0.314 0 CA-C-O 120.583 0.23 . . . . 0.0 111.209 -179.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.663 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.804 0.335 . . . . 0.0 110.947 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.595 ' NE2' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -54.24 -65.47 0.57 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.265 -179.55 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.604 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -56.34 -19.59 15.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.733 -177.693 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.604 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 16.6 tp60 -72.72 -80.59 0.06 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.028 0.442 . . . . 0.0 111.322 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' MET . . . . . 0.652 ' SD ' HD11 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.91 -95.41 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.658 -177.374 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.595 HD13 ' HD3' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -62.46 -2.38 1.04 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -175.06 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.592 ' O ' HD22 ' A' ' 24' ' ' LEU . . . 65.29 -116.35 8.71 Favored Glycine 0 N--CA 1.445 -0.763 0 N-CA-C 108.419 -1.872 . . . . 0.0 108.419 -173.77 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.562 ' HG3' HD21 ' A' ' 55' ' ' LEU . 0.6 OUTLIER -76.65 -69.88 0.49 Allowed 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 169.407 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.694 ' HD2' ' HG2' ' A' ' 30' ' ' PRO . 12.8 tpt180 -160.11 14.33 0.13 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.325 -1.307 . . . . 0.0 107.951 175.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.568 ' HA ' HD12 ' A' ' 31' ' ' LEU . 3.9 mm? -57.76 -76.2 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.423 -1.262 . . . . 0.0 113.329 -174.281 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.607 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -39.02 -47.11 3.68 Favored Pre-proline 0 CA--C 1.538 0.517 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -175.815 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.694 ' HG2' ' HD2' ' A' ' 27' ' ' ARG . 52.1 Cg_exo -57.36 -43.31 53.2 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.333 2.022 . . . . 0.0 113.817 -178.145 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.568 HD12 ' HA ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -70.58 -47.44 60.24 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.395 0.617 . . . . 0.0 109.955 -178.488 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.743 HG12 HG13 ' A' ' 69' ' ' VAL . 0.7 OUTLIER -73.99 -13.15 15.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.227 178.468 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.645 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.2 OUTLIER -62.54 -40.85 98.1 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 176.834 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.13 -30.06 70.47 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 174.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' MET . . . . . 0.571 ' SD ' HG12 ' A' ' 69' ' ' VAL . 6.6 mtt -101.69 25.93 7.96 Favored 'General case' 0 N--CA 1.461 0.09 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.443 178.199 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.645 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.8 p-80 -65.32 -32.87 6.85 Favored Pre-proline 0 CA--C 1.535 0.392 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 -177.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.551 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 57.3 Cg_exo -36.69 -33.01 0.13 Allowed 'Trans proline' 0 C--N 1.36 1.181 0 C-N-CA 122.183 1.922 . . . . 0.0 112.182 179.407 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.407 ' HB ' ' H ' ' A' ' 39' ' ' LEU . 1.1 m -79.06 -86.31 0.07 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.982 -0.553 . . . . 0.0 109.732 176.573 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.503 ' HB2' HD12 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -171.36 65.03 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.194 0 CA-C-O 120.719 0.295 . . . . 0.0 111.371 177.982 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.525 ' HB1' ' HB ' ' A' ' 32' ' ' ILE . . . -52.62 -29.1 24.24 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.127 179.165 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.607 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -49.49 -56.83 10.24 Favored Glycine 0 N--CA 1.452 -0.234 0 CA-C-N 115.805 -0.634 . . . . 0.0 114.053 -178.38 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.59 ' O ' ' HG2' ' A' ' 46' ' ' MET . 0.0 OUTLIER -77.93 -37.99 46.47 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -177.345 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.74 ' HB ' HD11 ' A' ' 32' ' ' ILE . 22.0 mt -53.18 -54.19 18.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 C-N-CA 120.952 -0.299 . . . . 0.0 111.562 -177.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.535 HG22 ' CD2' ' A' ' 29' ' ' PHE . 5.1 t -46.8 -49.46 19.89 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.402 ' CA ' ' HB2' ' B' ' 13' ' ' PHE . . . -55.16 -48.56 67.56 Favored Glycine 0 N--CA 1.449 -0.451 0 CA-C-N 115.878 -0.601 . . . . 0.0 112.796 178.615 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.59 ' HG2' ' O ' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -54.94 -69.78 0.12 Allowed 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.461 0.648 . . . . 0.0 111.066 -179.079 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.668 HD23 ' HB2' ' B' ' 7' ' ' ASN . 2.5 mp -80.03 17.64 0.96 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.832 -177.142 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.584 ' HB3' ' HD2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -65.98 -23.47 66.59 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 121.161 0.505 . . . . 0.0 109.755 177.009 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.533 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 1.2 mt-10 -74.58 23.46 0.09 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.01 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.504 ' H ' ' C ' ' A' ' 48' ' ' LEU . 3.5 tt -84.7 169.52 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.932 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.525 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 30.6 m-20 -70.96 159.59 34.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.615 -179.569 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.515 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 8.0 m120 -89.09 -28.31 20.19 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.897 177.232 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -74.05 -30.15 62.26 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 177.144 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.525 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 1.2 mm-40 -78.87 -28.77 44.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.656 178.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.562 HD21 ' HG3' ' A' ' 26' ' ' GLU . 0.7 OUTLIER -59.18 -45.93 89.73 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.07 179.6 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.642 ' HA ' HD22 ' A' ' 59' ' ' LEU . 7.1 tt -60.1 -49.97 75.54 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.6 179.022 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -58.59 -32.05 68.61 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.284 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.543 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -62.85 -55.62 24.66 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.067 -179.77 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.642 HD22 ' HA ' ' A' ' 56' ' ' LEU . 2.3 pp -66.14 -6.21 12.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.028 0.442 . . . . 0.0 110.369 178.62 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.521 ' O ' ' HG3' ' A' ' 60' ' ' GLU . 9.4 tp10 -105.12 -13.95 15.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.606 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.526 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -122.66 91.37 49.56 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.966 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -63.79 -31.25 68.57 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.303 2.002 . . . . 0.0 112.151 179.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.579 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.61 -45.44 21.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.15 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.579 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 19.1 m -72.73 -56.36 5.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.011 0.434 . . . . 0.0 111.537 -178.633 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.625 HD13 ' N ' ' A' ' 66' ' ' ARG . 0.2 OUTLIER -57.86 -60.69 3.32 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.621 -177.999 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.625 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -51.78 -35.41 43.72 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.22 -177.752 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.516 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 2.8 m -65.52 -37.76 87.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.102 0.477 . . . . 0.0 110.194 178.23 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.448 ' HE3' ' CD1' ' A' ' 50' ' ' ILE . 0.5 OUTLIER -66.39 -55.08 17.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.574 179.019 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.833 ' HA ' ' HB1' ' A' ' 72' ' ' ALA . 61.4 t -67.99 -16.14 20.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.564 179.504 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.561 ' O ' HG23 ' A' ' 73' ' ' VAL . 8.7 t70 -58.04 -49.46 76.8 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 176.101 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.533 ' O ' ' HB2' ' A' ' 74' ' ' ALA . 0.4 OUTLIER -68.9 -20.07 64.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.734 176.354 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.833 ' HB1' ' HA ' ' A' ' 69' ' ' VAL . . . -65.63 -47.72 74.64 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.732 179.434 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.674 ' HA ' HD13 ' A' ' 43' ' ' ILE . 2.4 m -57.17 -30.5 34.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 176.62 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.533 ' HB2' ' O ' ' A' ' 71' ' ' GLU . . . -68.33 -32.18 72.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.837 178.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.562 HG22 ' N ' ' A' ' 76' ' ' LEU . 1.2 m -60.81 -30.91 48.17 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.131 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 178.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.562 ' N ' HG22 ' A' ' 75' ' ' VAL . 30.6 mt -67.82 -50.55 56.11 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.271 0.557 . . . . 0.0 109.602 176.276 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -51.53 -39.18 57.21 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.343 179.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.93 -25.11 35.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.848 177.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 . . . . . 0 C--N 1.332 -0.164 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.956 -179.557 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.457 -0.11 0 CA-C-O 120.852 0.358 . . . . 0.0 110.981 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.461 ' HB3' ' CD2' ' A' ' 47' ' ' LEU . 0.0 OUTLIER -82.78 -79.0 0.2 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.818 179.678 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 7' ' ' ASN . . . . . 0.668 ' HB2' HD23 ' A' ' 47' ' ' LEU . 6.2 t30 -84.98 127.63 63.76 Favored Pre-proline 0 C--N 1.331 -0.219 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.129 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -80.17 13.48 2.19 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 122.357 2.038 . . . . 0.0 111.884 178.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 9' ' ' ASN . . . . . 0.506 ' HB3' ' OE2' ' A' ' 49' ' ' GLU . 25.8 m-20 -123.61 28.31 7.02 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.31 -179.501 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . 0.502 ' CB ' ' HB3' ' A' ' 46' ' ' MET . . . -59.39 96.41 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.818 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.533 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 1.7 mttp -130.11 -178.4 4.72 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.473 178.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -68.87 161.34 28.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.658 0.266 . . . . 0.0 111.061 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' PHE . . . . . 0.402 ' HB2' ' CA ' ' A' ' 45' ' ' GLY . 1.0 OUTLIER . . . . . 0 C--O 1.232 0.173 0 CA-C-O 120.957 0.408 . . . . 0.0 110.697 179.427 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.525 ' HG2' HE22 ' A' ' 20' ' ' GLN . 24.0 mttp . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.813 0.339 . . . . 0.0 110.516 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . 0.584 ' HD2' ' HB3' ' A' ' 48' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.983 -179.449 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.797 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 8.0 t . . . . . 0 CA--C 1.522 -0.112 0 CA-C-O 120.51 0.195 . . . . 0.0 110.718 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.459 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.55 -38.31 80.73 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 176.703 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.9 t -67.61 -35.04 78.21 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.459 -0.792 . . . . 0.0 109.347 176.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.797 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.7 mtm -64.42 -34.58 78.52 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.945 177.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.459 ' HB2' ' O ' ' A' ' 9' ' ' ALA . 1.2 mp -54.88 -44.83 74.41 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.367 179.036 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.3 -37.18 84.82 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.884 178.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.28 47.02 0.92 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.989 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.696 ' O ' ' HB2' ' A' ' 19' ' ' GLU . . . . . . . . 0 CA--C 1.537 0.461 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -177.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.696 ' HB2' ' O ' ' A' ' 15' ' ' ALA . 1.4 tp10 . . . . . 0 N--CA 1.461 0.089 0 CA-C-O 120.631 0.253 . . . . 0.0 110.838 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.609 ' NE2' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -46.88 -55.67 7.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.34 -178.386 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.702 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -56.26 -24.2 41.24 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.84 -178.571 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.572 ' H ' ' HD3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -72.54 -78.36 0.09 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.899 0.38 . . . . 0.0 111.862 -179.299 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' MET . . . . . 0.552 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.29 -95.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -176.37 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.552 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -60.39 -0.23 0.23 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -175.353 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 65.18 -115.69 8.02 Favored Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 108.431 -1.868 . . . . 0.0 108.431 -174.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.835 ' HG3' HD21 ' A' ' 55' ' ' LEU . 0.5 OUTLIER -75.52 -70.11 0.45 Allowed 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 168.64 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.614 ' NE ' HD22 ' A' ' 59' ' ' LEU . 12.7 tpt85 -160.37 10.53 0.1 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.152 -1.385 . . . . 0.0 107.67 174.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.791 HD23 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -58.88 -72.62 0.1 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 114.236 -1.347 . . . . 0.0 113.778 -173.025 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.662 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -35.81 -49.31 1.48 Allowed Pre-proline 0 CA--C 1.538 0.503 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -176.134 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.493 ' O ' ' HB3' ' A' ' 33' ' ' GLN . 53.0 Cg_exo -58.69 -42.39 54.19 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.436 2.091 . . . . 0.0 113.633 -178.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.847 ' HB3' HD12 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.09 -47.64 61.03 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.07 0.462 . . . . 0.0 109.998 -178.559 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.774 HD13 ' HB ' ' A' ' 43' ' ' ILE . 0.5 OUTLIER -75.07 -12.06 14.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.199 178.258 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.607 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 50.3 tp60 -62.39 -39.23 92.54 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 177.174 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.58 -30.23 67.95 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.011 174.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' MET . . . . . 0.625 ' HE1' ' HA ' ' A' ' 66' ' ' ARG . 6.7 mtt -100.55 28.25 5.22 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.333 178.116 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.607 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -64.96 -31.33 5.26 Favored Pre-proline 0 CA--C 1.536 0.433 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.324 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.576 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 55.7 Cg_exo -35.28 -33.03 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.265 0 C-N-CA 122.365 2.043 . . . . 0.0 112.535 179.549 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.402 ' N ' ' O ' ' A' ' 36' ' ' HIS . 67.8 m -78.18 -85.31 0.07 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.122 177.377 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.558 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.2 OUTLIER -171.19 50.85 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.547 179.014 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.509 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -37.02 -38.81 0.2 Allowed 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -179.536 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.662 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -44.23 -63.74 2.25 Favored Glycine 0 C--N 1.33 0.206 0 CA-C-N 115.998 -0.546 . . . . 0.0 114.208 -179.265 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.641 ' HZ2' ' HG2' ' B' ' 12' ' ' GLU . 0.8 OUTLIER -77.48 -27.56 52.0 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.257 0.465 . . . . 0.0 112.257 -177.267 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.774 ' HB ' HD13 ' A' ' 32' ' ' ILE . 1.2 mt -54.01 -50.51 53.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.662 0.268 . . . . 0.0 111.195 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.791 ' HA ' HD23 ' A' ' 28' ' ' LEU . 10.6 t -55.4 -46.38 76.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.58 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.573 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -50.05 -59.38 7.58 Favored Glycine 0 N--CA 1.452 -0.253 0 CA-C-N 115.986 -0.552 . . . . 0.0 113.234 -179.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.499 ' SD ' ' HG3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -56.89 -53.51 57.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.659 0.266 . . . . 0.0 111.371 -178.92 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.702 HD12 ' HB2' ' B' ' 7' ' ' ASN . 2.8 mm? -80.3 10.97 3.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.767 -178.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.573 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.48 -20.53 66.39 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.827 0.346 . . . . 0.0 110.613 179.711 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.524 ' HB2' ' ND2' ' B' ' 7' ' ' ASN . 2.2 mt-10 -76.0 21.54 0.17 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.793 179.222 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.68 HG22 ' HG2' ' A' ' 26' ' ' GLU . 0.2 OUTLIER -83.55 163.41 2.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.915 -179.669 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.481 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 1.3 m-20 -70.61 155.67 40.44 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.763 -178.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.544 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 5.4 m120 -84.87 -29.94 24.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.861 177.418 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.665 ' HA ' HD23 ' A' ' 56' ' ' LEU . 18.3 m -74.09 -28.49 61.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.298 0.57 . . . . 0.0 109.677 177.021 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.518 ' O ' ' HG2' ' A' ' 58' ' ' MET . 0.2 OUTLIER -80.16 -28.28 38.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.402 178.839 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.835 HD21 ' HG3' ' A' ' 26' ' ' GLU . 0.8 OUTLIER -59.7 -47.52 85.33 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.684 -179.699 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.746 ' HA ' HD21 ' A' ' 59' ' ' LEU . 1.0 OUTLIER -64.31 -43.24 95.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.725 179.955 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 9.1 m-70 -58.8 -21.83 56.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.118 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.596 ' SD ' ' HE2' ' A' ' 68' ' ' LYS . 28.2 mmt -76.59 -49.54 16.07 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.472 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.746 HD21 ' HA ' ' A' ' 56' ' ' LEU . 2.6 pp -66.14 -10.63 42.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.673 0.273 . . . . 0.0 110.895 -179.703 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -106.8 -5.52 18.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.707 178.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.593 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 3.6 m -122.52 81.83 47.14 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.946 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -58.49 -33.74 98.23 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.239 1.959 . . . . 0.0 111.83 179.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -78.51 -48.84 14.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.82 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.593 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 15.5 m -70.98 -53.36 15.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.888 0.375 . . . . 0.0 111.533 -177.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.847 HD12 ' HB3' ' A' ' 31' ' ' LEU . 0.2 OUTLIER -58.01 -61.39 2.58 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.434 -178.405 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.625 ' HA ' ' HE1' ' A' ' 35' ' ' MET . 0.8 OUTLIER -49.69 -34.54 18.89 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.141 -177.679 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 15.1 m -68.37 -39.18 81.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.248 0.547 . . . . 0.0 110.149 178.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.596 ' HE2' ' SD ' ' A' ' 58' ' ' MET . 0.2 OUTLIER -65.99 -56.35 12.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.552 179.201 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.647 HG22 HD22 ' A' ' 65' ' ' LEU . 21.0 t -63.87 -20.74 27.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.345 178.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.601 ' O ' HG22 ' A' ' 73' ' ' VAL . 21.4 t70 -53.88 -48.68 69.83 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 176.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -68.28 -29.47 68.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.937 176.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.751 ' HA ' HG11 ' A' ' 75' ' ' VAL . . . -58.35 -47.22 84.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.001 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.774 ' HA ' HD11 ' A' ' 43' ' ' ILE . 2.0 m -58.84 -31.72 45.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 177.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.03 -39.39 79.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.3 179.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.751 HG11 ' HA ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -55.73 -29.74 25.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-O 120.948 0.404 . . . . 0.0 109.917 179.487 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.689 HD21 HG12 ' A' ' 43' ' ' ILE . 3.5 mm? -71.84 -51.01 24.58 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.338 177.341 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 -50.75 -34.76 28.46 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.223 -0.898 . . . . 0.0 110.004 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -82.0 -31.33 31.13 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.684 177.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 1.6 t60 . . . . . 0 C--N 1.333 -0.143 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.055 -179.68 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 9.7 m120 . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.703 0.287 . . . . 0.0 111.015 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.59 ' HB2' HD13 ' A' ' 47' ' ' LEU . 14.2 mt -64.0 -76.51 0.07 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.765 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 7' ' ' ASN . . . . . 0.702 ' HB2' HD12 ' A' ' 47' ' ' LEU . 2.0 t30 -76.62 126.57 85.87 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.669 179.066 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -74.61 -4.46 15.45 Favored 'Trans proline' 0 N--CA 1.46 -0.476 0 C-N-CA 122.307 2.005 . . . . 0.0 112.037 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -123.65 54.8 1.28 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.022 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.27 92.09 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.441 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.447 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 0.1 OUTLIER -109.47 165.76 11.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.628 179.137 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . 0.641 ' HG2' ' HZ2' ' A' ' 42' ' ' LYS . 1.8 tm-20 -67.85 165.07 18.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.65 179.374 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' PHE . . . . . 0.502 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.1 t80 . . . . . 0 C--N 1.33 -0.255 0 CA-C-O 120.978 0.418 . . . . 0.0 110.635 179.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.702 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.881 0.372 . . . . 0.0 110.725 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.932 -179.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.737 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 10.5 t . . . . . 0 N--CA 1.455 -0.179 0 CA-C-O 120.706 0.289 . . . . 0.0 110.382 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.36 -37.24 77.39 Favored 'General case' 0 N--CA 1.455 -0.225 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 177.201 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -70.72 -35.6 72.8 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.905 177.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.737 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 10.9 mtm -64.17 -36.85 85.42 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 177.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.644 HD11 ' HB3' ' A' ' 24' ' ' LEU . 1.4 mp -51.69 -52.43 48.31 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.975 179.047 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.45 -33.27 75.33 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.307 178.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.51 30.91 4.0 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.908 -178.118 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.466 ' HB1' ' O ' ' A' ' 11' ' ' MET . . . . . . . . 0 C--N 1.331 -0.235 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.044 179.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.532 ' HA ' ' OE1' ' A' ' 19' ' ' GLU . 0.7 OUTLIER . . . . . 0 N--CA 1.453 -0.295 0 CA-C-O 120.668 0.271 . . . . 0.0 110.792 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.534 HE22 ' HB3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -46.73 -66.76 0.36 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.054 -0.521 . . . . 0.0 112.11 -177.568 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.717 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -56.74 -19.17 15.46 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -177.372 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.626 ' N ' ' HD2' ' A' ' 21' ' ' LYS . 1.8 tt0 -72.72 -78.05 0.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.911 0.386 . . . . 0.0 111.294 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' MET . . . . . 0.642 ' HA ' ' HE1' ' A' ' 11' ' ' MET . 0.0 OUTLIER -69.47 -97.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.419 -177.074 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.644 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -61.79 -1.04 0.54 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -175.836 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 65.1 -115.84 8.21 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 108.463 -1.855 . . . . 0.0 108.463 -174.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.834 ' HG3' HD21 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -76.06 -69.54 0.49 Allowed 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 169.447 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.587 HH11 HD22 ' A' ' 24' ' ' LEU . 6.3 tpt180 -159.63 12.21 0.13 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 114.309 -1.314 . . . . 0.0 108.107 176.622 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.763 ' HA ' HD12 ' A' ' 31' ' ' LEU . 3.8 mm? -57.76 -84.14 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.44 -1.255 . . . . 0.0 113.923 -173.412 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.635 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -32.66 -51.53 0.61 Allowed Pre-proline 0 CA--C 1.535 0.392 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -174.977 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.559 ' HG2' ' O ' ' A' ' 27' ' ' ARG . 10.0 Cg_endo -56.03 -41.98 71.32 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.479 2.119 . . . . 0.0 113.787 -177.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.763 HD12 ' HA ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -70.61 -48.81 53.27 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 120.019 -0.672 . . . . 0.0 109.748 -179.427 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.745 HG12 HG12 ' A' ' 69' ' ' VAL . 0.7 OUTLIER -72.17 -13.51 16.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.304 178.578 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.644 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 1.8 tp-100 -62.41 -40.01 95.15 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 177.312 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.71 -29.92 70.02 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.227 -0.897 . . . . 0.0 108.882 174.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' MET . . . . . 0.542 ' SD ' HG11 ' A' ' 69' ' ' VAL . 6.8 mtt -101.65 25.61 8.3 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.399 177.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.797 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 0.1 OUTLIER -64.07 -32.76 8.09 Favored Pre-proline 0 CA--C 1.536 0.429 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 -177.271 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.797 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 4.0 Cg_exo -36.21 -32.74 0.11 Allowed 'Trans proline' 0 C--N 1.364 1.343 0 C-N-CA 122.498 2.132 . . . . 0.0 112.099 179.33 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.817 HG21 HG11 ' A' ' 73' ' ' VAL . 0.2 OUTLIER -78.23 -87.23 0.06 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.898 176.83 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.73 ' HB3' HD22 ' A' ' 76' ' ' LEU . 0.3 OUTLIER -171.29 59.97 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.371 178.388 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.511 ' HB3' ' HB ' ' A' ' 32' ' ' ILE . . . -48.64 -31.36 6.6 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 120.894 0.378 . . . . 0.0 111.309 179.475 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.635 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -44.43 -63.99 2.21 Favored Glycine 0 N--CA 1.453 -0.225 0 CA-C-N 115.684 -0.689 . . . . 0.0 114.372 -178.505 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.572 ' HE3' ' HG3' ' B' ' 12' ' ' GLU . 0.0 OUTLIER -77.79 -29.61 50.93 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -176.999 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.676 ' HB ' HD13 ' A' ' 32' ' ' ILE . 15.9 mt -53.88 -53.92 23.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.467 -178.622 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.52 HG22 ' CD2' ' A' ' 29' ' ' PHE . 6.7 t -47.14 -46.6 23.36 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.143 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.624 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -53.44 -61.06 7.37 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.917 -0.583 . . . . 0.0 113.022 179.304 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.539 ' SD ' ' HG3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.45 -52.6 63.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.665 0.269 . . . . 0.0 111.492 -178.516 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.565 HD13 ' HB3' ' B' ' 6' ' ' LEU . 3.0 mm? -80.04 5.72 13.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.685 -178.327 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.458 ' C ' ' H ' ' A' ' 50' ' ' ILE . 0.0 OUTLIER -66.0 -16.58 64.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.837 0.351 . . . . 0.0 110.717 179.57 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.48 ' HG3' ' O ' ' B' ' 9' ' ' ASN . 3.4 mm-40 -76.65 18.84 0.3 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.807 179.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.568 HG21 ' HG2' ' A' ' 26' ' ' GLU . 0.4 OUTLIER -83.23 161.3 3.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.528 179.89 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.528 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 6.3 m-20 -70.49 155.51 40.61 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.98 0.419 . . . . 0.0 111.51 -178.394 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.516 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 5.1 m120 -83.33 -30.95 27.08 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.323 178.544 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.2 t -74.04 -33.7 63.82 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.302 0.572 . . . . 0.0 109.521 177.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.528 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -77.96 -24.93 47.95 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.552 179.445 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.834 HD21 ' HG3' ' A' ' 26' ' ' GLU . 0.7 OUTLIER -60.28 -48.11 83.15 Favored 'General case' 0 C--O 1.231 0.121 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 178.461 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.47 HD21 ' HA ' ' A' ' 56' ' ' LEU . 2.0 tm? -58.71 -39.88 82.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.094 178.679 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.473 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 12.9 t-80 -60.19 -40.21 89.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.543 178.707 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.543 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -62.21 -41.65 98.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.073 0.463 . . . . 0.0 110.309 178.815 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.444 HD13 ' NE ' ' A' ' 27' ' ' ARG . 8.1 tt -67.19 -19.51 65.58 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.7 178.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' A' ' 57' ' ' HIS . 5.2 pt-20 -105.03 -6.6 19.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.52 -178.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.556 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.3 OUTLIER -123.0 86.79 50.94 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.139 -179.69 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.446 ' O ' ' HB2' ' A' ' 66' ' ' ARG . 23.9 Cg_endo -61.3 -30.13 87.3 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.18 1.92 . . . . 0.0 111.863 179.038 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -78.09 -51.13 10.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.436 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.404 ' O ' ' HB2' ' A' ' 67' ' ' SER . 66.9 m -69.83 -50.43 42.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.633 -178.307 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.596 HD13 ' N ' ' A' ' 66' ' ' ARG . 0.0 OUTLIER -58.03 -59.77 4.75 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.282 -178.626 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.596 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -51.78 -30.27 22.31 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.618 -178.635 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.555 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 2.5 m -67.36 -37.71 83.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.314 178.356 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.52 ' O ' HD21 ' B' ' 6' ' ' LEU . 3.2 mtmm -65.72 -59.33 4.02 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.164 178.516 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.851 ' HA ' ' HB2' ' A' ' 72' ' ' ALA . 74.9 t -62.75 -18.71 21.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.58 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.555 ' HB3' ' O ' ' A' ' 67' ' ' SER . 7.3 t70 -56.92 -48.82 77.35 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 176.2 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.44 ' O ' HG13 ' A' ' 75' ' ' VAL . 43.8 tt0 -67.87 -29.31 68.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.628 176.24 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.851 ' HB2' ' HA ' ' A' ' 69' ' ' VAL . . . -59.27 -42.74 91.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.341 178.45 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.817 HG11 HG21 ' A' ' 38' ' ' THR . 14.6 t -60.73 -30.52 47.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 176.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.52 -31.88 63.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.056 178.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.787 HG12 ' HA ' ' A' ' 72' ' ' ALA . 1.1 m -61.0 -30.02 46.81 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.084 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 179.234 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.73 HD22 ' HB3' ' A' ' 39' ' ' LEU . 76.2 mt -65.94 -56.67 10.54 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 121.233 0.54 . . . . 0.0 109.942 177.227 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 21.2 mm100 -51.02 -36.11 37.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.026 -0.988 . . . . 0.0 110.591 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.81 -27.54 33.6 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.042 178.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.587 ' HB2' ' O ' ' A' ' 75' ' ' VAL . 0.9 OUTLIER . . . . . 0 C--N 1.331 -0.218 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.196 -179.337 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.726 0.298 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.565 ' HB3' HD13 ' A' ' 47' ' ' LEU . 9.7 tp -62.82 -81.36 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.769 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 7' ' ' ASN . . . . . 0.554 HD21 ' H ' ' B' ' 9' ' ' ASN . 1.3 t30 -78.75 130.03 71.92 Favored Pre-proline 0 C--N 1.332 -0.194 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.706 178.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.93 1.38 8.95 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.107 1.871 . . . . 0.0 112.108 179.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 9' ' ' ASN . . . . . 0.554 ' H ' HD21 ' B' ' 7' ' ' ASN . 17.2 m-80 -123.52 46.71 2.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.918 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.27 95.82 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.573 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -121.49 170.46 9.64 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.502 178.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . 0.572 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 2.3 tt0 -68.06 163.8 21.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.795 0.331 . . . . 0.0 111.03 179.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 13' ' ' PHE . . . . . 0.624 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.2 t80 . . . . . 0 C--N 1.332 -0.185 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.152 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.717 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.064 0 CA-C-O 120.929 0.395 . . . . 0.0 110.954 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 2.4 t80 . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.004 -179.912 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.798 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 10.8 t . . . . . 0 N--CA 1.456 -0.157 0 CA-C-O 120.727 0.299 . . . . 0.0 110.521 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.505 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.46 -38.26 80.31 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 176.857 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 10.7 t -71.13 -34.35 70.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.608 177.184 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.798 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 5.3 mtm -64.36 -33.92 76.96 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 177.139 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.525 HD12 ' SD ' ' A' ' 23' ' ' MET . 3.7 mp -52.79 -54.66 30.89 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.891 178.421 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.32 -25.92 67.06 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.242 178.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.1 m -101.66 14.02 33.2 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.963 -178.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.642 ' HB2' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.33 -0.279 0 CA-C-O 120.515 0.198 . . . . 0.0 111.281 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.642 ' HB3' ' HB2' ' A' ' 15' ' ' ALA . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.774 0.321 . . . . 0.0 110.92 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.52 ' HA ' ' HE3' ' A' ' 23' ' ' MET . 0.0 OUTLIER -60.87 -49.44 77.48 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.354 179.626 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.552 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -56.88 -21.74 31.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.255 -179.82 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.552 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 12.5 tp60 -73.84 -80.49 0.07 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.035 0.445 . . . . 0.0 111.641 179.562 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' MET . . . . . 0.592 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -70.05 -94.87 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -176.032 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.592 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -58.91 0.96 0.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -174.993 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.83 -117.13 9.87 Favored Glycine 0 N--CA 1.444 -0.791 0 N-CA-C 108.342 -1.903 . . . . 0.0 108.342 -174.488 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 51' ' ' ASP . 2.2 mp0 -76.06 -69.12 0.52 Allowed 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 169.083 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.689 ' HG3' HD22 ' A' ' 31' ' ' LEU . 1.7 tpt180 -159.99 9.27 0.1 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.259 -1.337 . . . . 0.0 107.939 175.065 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.858 HD23 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.59 -69.78 0.19 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 114.308 -1.315 . . . . 0.0 113.561 -173.61 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.57 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -37.93 -49.0 3.02 Favored Pre-proline 0 CA--C 1.538 0.503 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -175.847 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.597 ' HG2' ' HD2' ' A' ' 27' ' ' ARG . 46.5 Cg_exo -58.97 -43.89 39.52 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 122.37 2.046 . . . . 0.0 113.505 -178.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.773 HD13 ' HA ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -70.89 -46.02 63.32 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.216 -178.313 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.707 HD13 ' HB ' ' A' ' 43' ' ' ILE . 0.4 OUTLIER -74.96 -12.61 15.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.166 178.087 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.636 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -62.09 -39.77 93.57 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 176.557 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.46 -31.77 72.16 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.058 174.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' MET . . . . . 0.548 ' SD ' HG11 ' A' ' 69' ' ' VAL . 6.4 mtt -100.23 27.42 5.66 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.394 178.185 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.636 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 2.0 p-80 -65.31 -31.99 5.8 Favored Pre-proline 0 CA--C 1.536 0.431 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 -177.383 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.564 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 47.5 Cg_exo -35.78 -32.53 0.1 OUTLIER 'Trans proline' 0 C--N 1.361 1.209 0 C-N-CA 122.278 1.985 . . . . 0.0 112.597 179.709 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.438 ' O ' HD21 ' A' ' 39' ' ' LEU . 16.9 m -78.28 -83.27 0.09 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.131 177.144 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.658 ' HB3' HD13 ' A' ' 76' ' ' LEU . 0.2 OUTLIER -171.09 52.77 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.201 178.828 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.532 ' HB3' ' HA ' ' A' ' 36' ' ' HIS . . . -38.33 -42.54 0.72 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.97 -179.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.57 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -52.73 -49.44 53.62 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 121.046 -0.597 . . . . 0.0 113.641 -178.706 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.569 ' H ' HD11 ' A' ' 39' ' ' LEU . 0.1 OUTLIER -77.05 -36.7 55.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 117.061 0.431 . . . . 0.0 111.616 -178.491 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.764 HD11 ' HA ' ' A' ' 73' ' ' VAL . 0.4 OUTLIER -53.63 -62.62 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.724 0.297 . . . . 0.0 110.721 -179.846 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.858 ' HA ' HD23 ' A' ' 28' ' ' LEU . 8.9 t -48.56 -44.11 36.26 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.261 178.622 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.858 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -48.12 -67.79 1.47 Allowed Glycine 0 C--O 1.227 -0.289 0 CA-C-N 115.655 -0.702 . . . . 0.0 113.201 179.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.489 ' H ' ' HG2' ' A' ' 46' ' ' MET . 0.0 OUTLIER -54.68 -56.83 14.97 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.797 0.295 . . . . 0.0 111.797 -178.057 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.802 HD23 ' HB2' ' B' ' 7' ' ' ASN . 2.8 mp -79.99 17.42 0.98 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 -177.683 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.615 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.72 -18.09 65.19 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.121 0.486 . . . . 0.0 109.871 177.044 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.595 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.1 mt-10 -74.65 19.96 0.13 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.335 179.513 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.453 ' H ' ' C ' ' A' ' 48' ' ' LEU . 1.8 tt -83.29 162.74 3.11 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-O 120.828 0.347 . . . . 0.0 110.959 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.463 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 1.1 m-20 -71.18 154.73 41.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.102 -0.499 . . . . 0.0 112.288 -178.298 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.509 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 1.8 m120 -82.54 -27.39 31.68 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.551 176.192 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -74.19 -32.91 63.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.805 177.585 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -75.71 -28.7 58.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.419 178.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 52' ' ' ASN . 0.4 OUTLIER -59.84 -46.94 87.7 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.149 179.288 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.57 -48.6 78.89 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.505 179.255 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -57.26 -40.12 77.01 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.865 179.776 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.551 ' SD ' ' HE2' ' A' ' 68' ' ' LYS . 12.9 mmt -64.41 -41.55 96.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.01 0.434 . . . . 0.0 110.294 179.104 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.9 tt -69.39 -14.99 63.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.78 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.58 -9.12 16.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.35 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.638 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -123.22 85.65 51.59 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.934 -179.678 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_endo -61.34 -33.1 89.76 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.295 1.997 . . . . 0.0 112.173 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.32 -46.36 20.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.463 -179.429 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 30.8 m -70.22 -48.39 57.26 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.859 0.361 . . . . 0.0 111.316 -178.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.638 ' HB3' ' O ' ' A' ' 61' ' ' SER . 0.1 OUTLIER -58.01 -58.57 7.82 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.749 -178.937 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.638 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -50.9 -34.07 26.87 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.241 -177.625 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.528 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 35.3 t -63.41 -41.95 98.75 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.118 0.485 . . . . 0.0 110.153 178.246 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.578 ' HG2' HD22 ' B' ' 6' ' ' LEU . 1.0 OUTLIER -66.21 -57.32 7.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.686 179.285 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.748 ' HA ' ' HB1' ' A' ' 72' ' ' ALA . 71.1 t -63.36 -19.08 23.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.775 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.6 ' O ' HG22 ' A' ' 73' ' ' VAL . 7.5 t70 -56.97 -48.85 77.42 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 176.539 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.87 -25.54 64.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.843 176.56 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.748 ' HB1' ' HA ' ' A' ' 69' ' ' VAL . . . -61.18 -48.78 79.99 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.845 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.764 ' HA ' HD11 ' A' ' 43' ' ' ILE . 2.6 m -58.68 -30.14 41.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 177.334 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.08 -37.98 78.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.287 -0.869 . . . . 0.0 111.196 179.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -57.31 -29.02 31.8 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 178.664 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.716 HD22 HG12 ' A' ' 43' ' ' ILE . 3.9 mm? -72.0 -50.7 26.47 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.073 177.081 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -51.38 -31.25 21.73 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.241 -0.891 . . . . 0.0 109.697 178.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.47 -30.09 33.51 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.581 177.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 2.7 t-160 . . . . . 0 C--N 1.333 -0.12 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.636 179.332 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 4.1 m120 . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.74 0.305 . . . . 0.0 110.997 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.578 HD22 ' HG2' ' A' ' 68' ' ' LYS . 0.8 OUTLIER -80.62 -81.43 0.13 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.84 -179.982 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 7' ' ' ASN . . . . . 0.802 ' HB2' HD23 ' A' ' 47' ' ' LEU . 2.1 t30 -81.47 122.82 81.22 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.757 179.452 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -78.54 9.88 3.02 Favored 'Trans proline' 0 N--CA 1.459 -0.517 0 C-N-CA 122.16 1.906 . . . . 0.0 112.034 179.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 9' ' ' ASN . . . . . 0.525 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 56.5 m-20 -123.25 34.33 5.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.034 -179.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.77 90.01 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.654 -179.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.595 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 1.9 mttm -129.1 138.56 51.91 Favored 'General case' 0 C--O 1.226 -0.179 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.132 178.625 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -46.58 163.04 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -177.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 13' ' ' PHE . . . . . 0.858 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.7 OUTLIER . . . . . 0 N--CA 1.463 0.187 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.786 179.433 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.425 ' HG2' HE22 ' A' ' 20' ' ' GLN . 5.0 mttm . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.906 0.384 . . . . 0.0 110.825 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.83 -179.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.8 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 8.2 t . . . . . 0 CA--C 1.521 -0.141 0 CA-C-O 120.704 0.288 . . . . 0.0 110.372 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.466 ' HB2' ' OE1' ' A' ' 33' ' ' GLN . . . -59.43 -39.24 82.87 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 176.418 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 39.3 t -68.94 -33.1 73.17 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.454 176.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.8 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.2 mtm -64.13 -34.86 79.01 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.818 177.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.491 HD12 ' HB3' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -55.25 -49.96 70.69 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.329 178.684 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.05 -32.41 73.86 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.611 178.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.1 m -101.38 46.67 0.93 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.76 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.763 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 CA--C 1.537 0.447 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 -178.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.763 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 2.1 tp10 . . . . . 0 N--CA 1.455 -0.203 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.512 ' O ' HD13 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -46.25 -56.31 5.95 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.672 -177.512 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.476 ' H ' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -56.02 -24.3 38.37 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.506 -178.342 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.464 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 17.1 tp60 -73.6 -78.45 0.09 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.908 0.385 . . . . 0.0 111.838 179.398 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' MET . . . . . 0.579 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -68.96 -97.29 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 112.997 0.74 . . . . 0.0 112.997 -175.93 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.579 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -57.03 0.34 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.275 0 N-CA-C 113.51 0.929 . . . . 0.0 113.51 -175.519 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.427 ' H ' ' C ' ' A' ' 23' ' ' MET . . . 64.79 -117.19 9.99 Favored Glycine 0 CA--C 1.505 -0.594 0 N-CA-C 108.269 -1.932 . . . . 0.0 108.269 -174.685 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.749 ' HG3' HD22 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -75.56 -68.27 0.58 Allowed 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 168.089 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.747 ' HE ' HD11 ' A' ' 59' ' ' LEU . 1.1 tpt180 -160.52 8.42 0.09 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.151 -1.386 . . . . 0.0 107.999 174.37 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.745 HD23 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.23 -73.96 0.08 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.551 -1.204 . . . . 0.0 113.896 -172.921 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.565 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.2 OUTLIER -36.79 -49.79 1.99 Allowed Pre-proline 0 CA--C 1.536 0.431 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -175.336 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.587 ' HG2' ' O ' ' A' ' 27' ' ' ARG . 12.4 Cg_endo -58.95 -41.69 59.41 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 121.975 1.783 . . . . 0.0 113.128 -178.053 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.739 HD11 ' HA ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -71.06 -45.44 63.79 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 120.339 -0.545 . . . . 0.0 110.182 -179.663 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.671 HG12 HG12 ' A' ' 69' ' ' VAL . 0.8 OUTLIER -71.56 -17.27 19.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.313 -0.403 . . . . 0.0 109.933 177.59 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.647 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 2.0 tt0 -63.26 -32.51 73.93 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 176.455 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.5 -29.64 65.04 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.679 -0.859 . . . . 0.0 108.679 175.02 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' MET . . . . . 0.545 ' HE3' HG11 ' A' ' 69' ' ' VAL . 8.9 mtt -100.08 19.67 15.91 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 114.84 -1.073 . . . . 0.0 109.72 177.242 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.647 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.6 OUTLIER -63.81 -34.8 13.25 Favored Pre-proline 0 CA--C 1.532 0.263 0 CA-C-N 115.511 -0.768 . . . . 0.0 112.106 -178.636 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.542 ' CD ' ' N ' ' A' ' 36' ' ' HIS . 87.4 Cg_exo -42.18 -26.22 0.5 Allowed 'Trans proline' 0 C--N 1.361 1.191 0 C-N-CA 121.769 1.646 . . . . 0.0 111.066 177.323 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.756 HG23 HG13 ' A' ' 73' ' ' VAL . 86.8 m -77.99 -80.95 0.1 Allowed 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.325 -0.852 . . . . 0.0 109.556 176.089 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.598 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -171.63 52.51 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 112.608 0.595 . . . . 0.0 112.608 178.61 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -56.86 149.51 18.33 Favored 'General case' 0 C--O 1.231 0.127 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 176.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.565 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . 132.57 -73.41 0.46 Allowed Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.566 -178.364 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.56 -28.17 51.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.698 0.285 . . . . 0.0 111.043 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.503 ' O ' HD22 ' A' ' 47' ' ' LEU . 55.2 mt -54.05 -53.77 25.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.795 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.745 ' HA ' HD23 ' A' ' 28' ' ' LEU . 13.1 t -54.25 -37.02 64.21 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.827 0.346 . . . . 0.0 110.538 178.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.839 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -48.12 -70.5 0.73 Allowed Glycine 0 N--CA 1.45 -0.418 0 CA-C-N 115.745 -0.661 . . . . 0.0 113.119 -179.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.629 ' HE1' HG23 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -55.36 -45.67 76.48 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -178.127 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.623 HD12 ' HB3' ' B' ' 6' ' ' LEU . 3.1 mm? -79.91 7.7 8.36 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -177.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.599 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.34 -7.38 18.6 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.881 0.372 . . . . 0.0 110.853 179.556 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.41 ' OE1' ' HG3' ' B' ' 11' ' ' LYS . 1.2 mm-40 -85.65 18.55 2.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.807 179.187 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.457 HG23 ' HG2' ' A' ' 26' ' ' GLU . 0.8 OUTLIER -83.72 162.63 3.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.861 -179.684 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.499 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 21.3 m-20 -70.96 157.58 37.95 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.902 0.382 . . . . 0.0 111.778 -178.506 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.551 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 3.1 m120 -87.07 -29.87 21.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.91 -0.587 . . . . 0.0 109.971 177.72 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.1 -30.51 62.37 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 177.094 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.499 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -78.38 -27.41 46.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.59 179.058 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.749 HD22 ' HG3' ' A' ' 26' ' ' GLU . 0.8 OUTLIER -61.6 -47.07 87.14 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.473 179.98 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 58.1 tp -61.9 -43.85 98.01 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.946 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -60.2 -28.48 68.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.443 -179.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.505 ' HE3' ' HE2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -68.39 -51.07 48.13 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.529 -179.076 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.747 HD11 ' HE ' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -63.58 -20.24 65.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.194 -179.303 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -95.53 -5.84 41.84 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.02 0.438 . . . . 0.0 110.496 178.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.618 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 5.1 m -122.69 79.46 48.27 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.631 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -55.29 -34.57 88.95 Favored 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 122.36 2.04 . . . . 0.0 112.178 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -78.41 -49.34 13.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.945 -179.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.525 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 15.7 m -69.2 -45.96 68.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.961 0.41 . . . . 0.0 111.39 -178.029 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.618 ' HB3' ' O ' ' A' ' 61' ' ' SER . 0.2 OUTLIER -59.46 -61.49 2.59 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.774 -178.558 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.618 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -50.78 -31.76 17.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.208 -177.538 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.516 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 20.7 t -63.86 -42.76 97.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.11 0.481 . . . . 0.0 110.276 178.346 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.505 ' HE2' ' HE3' ' A' ' 58' ' ' MET . 6.3 ttmm -66.31 -58.12 6.01 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.853 179.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.734 ' HA ' ' HB2' ' A' ' 72' ' ' ALA . 79.3 t -62.37 -20.78 25.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.616 179.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.516 ' HB3' ' O ' ' A' ' 67' ' ' SER . 9.6 t0 -54.71 -49.08 71.59 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 176.343 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.47 ' HG2' ' HB3' ' B' ' 5' ' ' ASN . 0.5 OUTLIER -68.88 -29.48 67.79 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.847 176.495 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.745 ' HA ' HG13 ' A' ' 75' ' ' VAL . . . -60.44 -38.01 82.74 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.087 178.068 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.756 HG13 HG23 ' A' ' 38' ' ' THR . 3.6 t -64.74 -29.35 47.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 176.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.15 -38.94 66.06 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.251 179.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.745 HG13 ' HA ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.07 -30.34 38.79 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-O 121.127 0.489 . . . . 0.0 110.086 179.343 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.598 ' HG ' ' HB3' ' A' ' 39' ' ' LEU . 3.0 tm? -71.19 -52.78 17.18 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.209 178.689 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -55.99 -34.52 65.85 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.614 179.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.01 -23.04 38.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.787 179.045 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.418 ' HB2' ' O ' ' A' ' 75' ' ' VAL . 19.3 t60 . . . . . 0 C--N 1.331 -0.229 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.86 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 5' ' ' ASN . . . . . 0.47 ' HB3' ' HG2' ' A' ' 71' ' ' GLU . 1.8 m-80 . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.753 0.311 . . . . 0.0 110.923 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.623 ' HB3' HD12 ' A' ' 47' ' ' LEU . 0.2 OUTLIER -71.27 -84.52 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.685 179.806 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 7' ' ' ASN . . . . . 0.435 ' H ' ' HB3' ' B' ' 6' ' ' LEU . 3.2 t30 -78.41 139.11 59.38 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.851 179.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -79.01 -9.21 15.5 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 122.328 2.018 . . . . 0.0 111.94 178.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 72.7 m-80 -123.31 57.79 1.14 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.79 179.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.76 93.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.603 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.41 ' HG3' ' OE1' ' A' ' 49' ' ' GLU . 10.2 mttp -114.02 125.19 53.71 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.337 179.038 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -48.74 168.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -177.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 13' ' ' PHE . . . . . 0.839 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.142 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.07 179.159 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.939 0.4 . . . . 0.0 110.674 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.008 -179.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.763 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 10.2 t . . . . . 0 CA--C 1.521 -0.135 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.452 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.48 -37.48 78.35 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 176.766 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.2 t -68.0 -34.73 77.08 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.739 177.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.763 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 12.0 mtm -64.21 -36.49 84.25 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.912 177.577 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.562 HD11 ' HB3' ' A' ' 24' ' ' LEU . 4.1 mp -52.15 -48.68 64.77 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.117 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.03 -30.89 71.5 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.022 178.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.514 ' HG ' ' HA ' ' A' ' 11' ' ' MET . 3.5 p -101.37 19.5 17.66 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.54 -178.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.555 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.21 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.555 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.9 OUTLIER . . . . . 0 N--CA 1.457 -0.114 0 CA-C-O 120.807 0.337 . . . . 0.0 110.83 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.496 ' O ' HD11 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -52.18 -57.61 9.11 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.372 -179.77 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.524 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.9 -20.37 15.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.539 -178.608 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.539 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 5.0 tp60 -73.2 -79.46 0.08 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.873 0.368 . . . . 0.0 111.341 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' MET . . . . . 0.575 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.87 -94.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -176.682 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.575 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -60.88 1.94 0.13 Allowed 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 113.682 0.993 . . . . 0.0 113.682 -174.876 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.86 -117.01 9.63 Favored Glycine 0 N--CA 1.445 -0.759 0 N-CA-C 108.359 -1.896 . . . . 0.0 108.359 -174.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.797 ' HG3' HD23 ' A' ' 55' ' ' LEU . 0.3 OUTLIER -75.49 -68.51 0.56 Allowed 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 107.24 -1.392 . . . . 0.0 107.24 168.572 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.537 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 3.6 tpt85 -160.34 9.37 0.1 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.303 -1.317 . . . . 0.0 108.223 174.643 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.771 HD21 ' HA ' ' A' ' 44' ' ' THR . 0.3 OUTLIER -58.73 -72.89 0.09 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 114.407 -1.27 . . . . 0.0 113.893 -173.244 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.633 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -36.01 -49.0 1.57 Allowed Pre-proline 0 CA--C 1.539 0.546 0 N-CA-C 113.318 0.858 . . . . 0.0 113.318 -175.454 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.527 ' O ' ' HB3' ' A' ' 33' ' ' GLN . 51.4 Cg_exo -59.39 -42.12 51.86 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.39 2.06 . . . . 0.0 113.573 -178.72 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.739 HD11 HD23 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.52 -46.84 62.87 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 120.458 -0.497 . . . . 0.0 109.987 -178.627 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.782 HG12 HG11 ' A' ' 69' ' ' VAL . 0.3 OUTLIER -74.57 -12.95 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.589 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.056 177.913 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.663 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 1.1 tt0 -62.46 -39.19 92.58 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 176.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.85 -30.5 69.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.432 -0.804 . . . . 0.0 108.881 174.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' MET . . . . . 0.639 ' SD ' HG13 ' A' ' 69' ' ' VAL . 7.4 mtt -100.3 26.0 7.02 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.254 177.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.663 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.7 p-80 -64.98 -32.22 6.37 Favored Pre-proline 0 CA--C 1.536 0.418 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -177.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.59 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 42.8 Cg_exo -33.65 -35.47 0.08 OUTLIER 'Trans proline' 0 C--N 1.365 1.405 0 C-N-CA 122.288 1.992 . . . . 0.0 112.133 179.212 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.412 ' HB ' ' H ' ' A' ' 39' ' ' LEU . 2.7 m -78.1 -88.87 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.458 175.877 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.861 ' HB3' HD13 ' A' ' 76' ' ' LEU . 0.2 OUTLIER -171.79 66.6 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.723 -0.217 . . . . 0.0 111.399 177.668 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.5 ' HB1' ' O ' ' A' ' 32' ' ' ILE . . . -48.13 -32.67 7.21 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.565 179.561 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.633 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -46.41 -60.26 4.8 Favored Glycine 0 CA--C 1.518 0.256 0 CA-C-N 115.988 -0.551 . . . . 0.0 114.384 -178.283 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.873 ' HE3' ' HG3' ' B' ' 12' ' ' GLU . 4.4 tptm -77.27 -33.23 55.91 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.938 0.369 . . . . 0.0 111.943 -177.364 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.681 HD12 ' HA ' ' A' ' 73' ' ' VAL . 29.9 mt -54.01 -57.67 5.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.739 -0.21 . . . . 0.0 111.062 -179.212 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.771 ' HA ' HD21 ' A' ' 28' ' ' LEU . 9.3 t -50.16 -42.61 51.31 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.889 0.376 . . . . 0.0 110.244 178.58 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.868 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -49.35 -67.13 1.88 Allowed Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.681 -0.691 . . . . 0.0 113.296 -179.822 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.652 ' HE1' HG21 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -55.4 -47.26 76.16 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.74 0.27 . . . . 0.0 111.488 -178.157 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.732 HD11 ' HB3' ' B' ' 6' ' ' LEU . 3.0 mm? -79.87 6.07 12.1 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -178.538 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.569 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.94 -10.58 40.3 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.915 0.388 . . . . 0.0 110.507 179.836 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.425 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 1.6 mm-40 -82.37 21.36 0.95 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.232 177.458 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.494 HG21 ' HG2' ' A' ' 26' ' ' GLU . 0.4 OUTLIER -83.53 160.73 3.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.991 -179.377 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.47 ' HB2' ' HG3' ' A' ' 54' ' ' GLU . 0.9 OUTLIER -70.87 156.61 39.36 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.658 -178.835 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.559 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 4.6 m120 -85.85 -27.87 24.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.197 178.037 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.82 -34.32 64.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.153 0.501 . . . . 0.0 109.769 177.672 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.52 ' O ' ' HG2' ' A' ' 58' ' ' MET . 4.5 mt-10 -76.43 -29.22 56.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.79 179.187 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.797 HD23 ' HG3' ' A' ' 26' ' ' GLU . 0.7 OUTLIER -58.98 -45.92 89.39 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.959 0.409 . . . . 0.0 109.961 179.495 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.762 ' HA ' HD11 ' A' ' 59' ' ' LEU . 0.4 OUTLIER -60.25 -44.35 95.34 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.668 179.453 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -64.96 -13.68 58.05 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.057 179.626 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.669 ' SD ' ' HE2' ' A' ' 68' ' ' LYS . 31.7 mmt -76.29 -56.91 4.21 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.466 -179.691 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.783 ' H ' HD12 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -67.1 -8.57 31.69 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 121.105 0.479 . . . . 0.0 110.429 178.927 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.528 ' O ' ' HG3' ' A' ' 60' ' ' GLU . 1.1 tp10 -98.61 -16.42 19.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.502 179.188 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.504 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 1.2 t -122.71 87.97 49.94 Favored Pre-proline 0 C--N 1.332 -0.153 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.373 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -60.22 -31.57 93.24 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.345 2.03 . . . . 0.0 111.89 179.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.458 ' O ' ' HB2' ' A' ' 67' ' ' SER . 6.9 mm-40 -77.87 -50.34 12.45 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.475 -179.693 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 67.8 m -69.38 -53.31 20.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.444 -178.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.739 HD23 HD11 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -57.99 -62.56 1.72 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.645 -178.177 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.456 ' HG2' ' CE ' ' A' ' 35' ' ' MET . 0.0 OUTLIER -49.93 -35.68 24.83 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.022 -177.639 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.49 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.2 OUTLIER -69.59 -36.14 75.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.159 0.504 . . . . 0.0 110.048 178.046 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.669 ' HE2' ' SD ' ' A' ' 58' ' ' MET . 0.1 OUTLIER -66.4 -53.88 30.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.659 179.248 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.782 HG11 HG12 ' A' ' 32' ' ' ILE . 40.0 t -68.05 -19.08 24.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.317 178.537 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.629 ' O ' HG22 ' A' ' 73' ' ' VAL . 19.4 t0 -55.68 -48.75 74.54 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 176.596 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.475 ' O ' HG13 ' A' ' 75' ' ' VAL . 1.2 tp10 -69.05 -26.34 64.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.739 176.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.714 ' HB2' ' HA ' ' A' ' 69' ' ' VAL . . . -60.78 -47.94 84.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.924 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.681 ' HA ' HD12 ' A' ' 43' ' ' ILE . 4.9 m -60.2 -28.33 41.41 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.156 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 177.108 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.433 ' O ' ' HG3' ' A' ' 77' ' ' GLN . . . -71.43 -30.26 65.85 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.133 178.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.686 HG12 ' HA ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -69.12 -36.16 71.99 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 CA-C-O 120.812 0.339 . . . . 0.0 110.476 179.592 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.861 HD13 ' HB3' ' A' ' 39' ' ' LEU . 0.2 OUTLIER -71.73 -56.32 6.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.939 179.782 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.433 ' HG3' ' O ' ' A' ' 74' ' ' ALA . 0.0 OUTLIER -52.41 -36.66 54.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.134 0.492 . . . . 0.0 110.332 179.794 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.8 -24.38 38.58 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.756 178.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.41 ' HB2' ' O ' ' A' ' 75' ' ' VAL . 77.2 t60 . . . . . 0 C--N 1.332 -0.185 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.727 179.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 49.1 m-80 . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.716 0.294 . . . . 0.0 111.32 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.732 ' HB3' HD11 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -62.57 -73.34 0.11 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.006 -179.394 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 7' ' ' ASN . . . . . 0.61 ' HB2' HD13 ' A' ' 47' ' ' LEU . 1.4 t30 -90.5 128.78 47.48 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.186 -179.636 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -77.79 -1.07 11.25 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.259 1.972 . . . . 0.0 111.798 178.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 9' ' ' ASN . . . . . 0.559 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 26.6 m120 -123.41 52.12 1.43 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.682 179.749 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . 0.643 ' HB2' ' HB3' ' A' ' 46' ' ' MET . . . -60.41 98.25 0.06 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.892 -179.553 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.559 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 2.7 mmtm -121.97 141.32 51.44 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.54 178.344 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . 0.873 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 17.2 mp0 -50.24 162.4 0.22 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.948 0.404 . . . . 0.0 111.999 -179.058 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 13' ' ' PHE . . . . . 0.868 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.9 OUTLIER . . . . . 0 CA--C 1.52 -0.206 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.614 177.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.902 0.382 . . . . 0.0 110.808 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.36 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.983 -179.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.771 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 8.9 t . . . . . 0 CA--C 1.521 -0.138 0 CA-C-O 120.614 0.245 . . . . 0.0 110.503 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.32 -39.4 82.97 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 176.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 10.9 t -69.69 -33.63 72.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.763 177.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.771 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.4 mtm -64.29 -37.04 86.08 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 116.169 -0.469 . . . . 0.0 109.888 177.726 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.744 HD12 ' HB3' ' A' ' 24' ' ' LEU . 1.4 mp -52.0 -51.83 54.66 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.205 179.125 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.22 -31.92 73.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.441 178.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.57 23.61 10.93 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.343 -0.39 . . . . 0.0 112.002 -178.137 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.638 ' HB3' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.329 -0.305 0 CA-C-O 120.555 0.217 . . . . 0.0 111.285 179.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.667 ' HG3' ' HB3' ' A' ' 22' ' ' GLN . 5.8 tp10 . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.683 0.278 . . . . 0.0 111.074 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.424 ' NE2' ' HG2' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -52.05 -58.36 6.76 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.387 -179.908 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.563 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.93 -21.81 22.67 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.543 -178.242 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.667 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 20.8 tp60 -73.39 -80.27 0.07 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.992 0.425 . . . . 0.0 111.654 179.683 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' MET . . . . . 0.622 ' HE2' ' HB1' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -69.62 -94.94 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -176.7 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.744 ' HB3' HD12 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -59.96 -1.34 0.28 Allowed 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 -174.819 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.576 ' O ' HD23 ' A' ' 24' ' ' LEU . . . 65.06 -116.93 9.47 Favored Glycine 0 N--CA 1.446 -0.648 0 N-CA-C 108.501 -1.84 . . . . 0.0 108.501 -174.54 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.635 ' HG3' HD21 ' A' ' 55' ' ' LEU . 0.7 OUTLIER -76.2 -67.23 0.7 Allowed 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 169.592 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.67 ' HD3' HD13 ' A' ' 24' ' ' LEU . 6.5 tpt180 -159.65 7.06 0.1 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.247 -1.342 . . . . 0.0 108.06 175.878 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.84 ' HA ' HD13 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -59.19 -78.06 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.441 -1.254 . . . . 0.0 114.26 -172.906 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.602 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -32.88 -48.84 0.58 Allowed Pre-proline 0 CA--C 1.541 0.601 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -175.099 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.579 ' CD ' ' HB2' ' A' ' 24' ' ' LEU . 20.1 Cg_endo -63.44 -39.33 37.31 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.336 2.024 . . . . 0.0 113.817 -178.107 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.84 HD13 ' HA ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -70.44 -45.48 65.72 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 119.997 -0.681 . . . . 0.0 109.506 179.981 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.731 HG12 HG12 ' A' ' 69' ' ' VAL . 0.4 OUTLIER -73.46 -13.29 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.688 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.698 177.46 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.647 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -62.52 -38.1 88.63 Favored 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 177.213 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.41 -28.98 65.49 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 174.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' MET . . . . . 0.555 ' SD ' HG11 ' A' ' 69' ' ' VAL . 7.8 mtt -100.16 25.61 7.32 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.087 177.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.647 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -64.62 -31.49 5.75 Favored Pre-proline 0 CA--C 1.536 0.422 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 -177.471 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.586 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 35.7 Cg_exo -33.31 -34.98 0.07 OUTLIER 'Trans proline' 0 C--N 1.364 1.352 0 C-N-CA 122.339 2.026 . . . . 0.0 112.034 178.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.426 ' N ' ' O ' ' A' ' 36' ' ' HIS . 0.2 OUTLIER -78.01 -90.99 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 175.383 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.825 ' HB3' HD13 ' A' ' 76' ' ' LEU . 0.1 OUTLIER -171.88 67.07 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.649 -0.251 . . . . 0.0 111.307 177.163 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.48 ' CB ' ' HB ' ' A' ' 32' ' ' ILE . . . -46.38 -28.74 1.43 Allowed 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.922 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.602 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -50.45 -62.08 5.43 Favored Glycine 0 CA--C 1.518 0.27 0 CA-C-N 116.172 -0.467 . . . . 0.0 113.941 -178.375 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.59 ' HB3' HD11 ' A' ' 76' ' ' LEU . 4.6 tptm -74.95 -33.71 61.96 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.021 0.378 . . . . 0.0 112.021 -177.299 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.603 HD13 ' HA ' ' A' ' 73' ' ' VAL . 30.5 mt -54.36 -57.37 6.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.432 -178.711 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.738 ' HA ' HD21 ' A' ' 28' ' ' LEU . 9.0 t -51.2 -45.52 61.88 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.898 0.38 . . . . 0.0 110.519 178.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.6 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -49.66 -64.8 3.2 Favored Glycine 0 N--CA 1.451 -0.311 0 CA-C-N 115.689 -0.687 . . . . 0.0 113.282 -179.452 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.493 ' SD ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.64 -47.57 76.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.83 0.315 . . . . 0.0 111.79 -178.374 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.727 HD11 ' HB2' ' B' ' 6' ' ' LEU . 3.5 mm? -80.18 6.58 11.35 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.649 0.24 . . . . 0.0 111.649 -178.733 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.6 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.17 -7.01 15.4 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.989 0.423 . . . . 0.0 110.77 179.897 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.435 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 3.2 mt-10 -81.67 16.85 1.61 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.295 177.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.492 HD12 ' HE3' ' A' ' 68' ' ' LYS . 1.0 OUTLIER -83.1 160.78 3.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.112 -179.187 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.447 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 1.5 m-20 -71.11 158.17 36.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.805 -178.765 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.476 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 3.9 m120 -86.69 -28.97 22.8 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.841 177.431 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.75 -32.62 63.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.37 0.605 . . . . 0.0 109.519 177.08 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.452 ' OE2' HD12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -75.7 -28.59 58.66 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.564 179.168 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.635 HD21 ' HG3' ' A' ' 26' ' ' GLU . 0.6 OUTLIER -60.52 -47.22 87.12 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.002 0.429 . . . . 0.0 110.348 179.533 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.425 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 52.1 tp -58.1 -43.69 87.23 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.555 179.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.463 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 1.7 t-80 -59.37 -41.29 88.98 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.67 179.122 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.524 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -61.21 -38.68 87.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.353 178.933 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.3 tt -68.11 -20.36 64.92 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.349 178.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.463 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 2.2 pt-20 -107.02 -2.62 20.92 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.458 -179.274 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.572 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 15.9 m -122.52 88.37 49.42 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.251 -178.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -62.19 -31.96 82.72 Favored 'Trans proline' 0 C--N 1.343 0.258 0 C-N-CA 122.1 1.867 . . . . 0.0 111.688 178.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.546 ' O ' ' HB2' ' A' ' 67' ' ' SER . 5.0 mt-10 -78.45 -50.44 11.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.765 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.9 t -69.17 -52.38 28.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.082 0.468 . . . . 0.0 111.424 -178.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.616 HD13 ' N ' ' A' ' 66' ' ' ARG . 0.2 OUTLIER -58.13 -64.3 0.96 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.62 -177.882 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.616 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -51.13 -35.04 33.6 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.195 -177.553 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.546 ' HB2' ' O ' ' A' ' 63' ' ' GLU . 0.2 OUTLIER -69.7 -36.41 75.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.9 0.381 . . . . 0.0 110.315 178.428 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.492 ' HE3' HD12 ' A' ' 50' ' ' ILE . 0.9 OUTLIER -66.32 -56.45 11.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.318 179.005 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.758 ' HA ' ' HB1' ' A' ' 72' ' ' ALA . 45.3 t -64.56 -21.07 28.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.492 179.039 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.581 ' O ' HG23 ' A' ' 73' ' ' VAL . 26.7 t70 -56.35 -48.4 76.87 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 176.713 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.41 ' O ' ' HB2' ' A' ' 74' ' ' ALA . 0.8 OUTLIER -68.9 -26.76 65.26 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.751 176.449 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.758 ' HB1' ' HA ' ' A' ' 69' ' ' VAL . . . -60.58 -46.62 89.54 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.527 -0.761 . . . . 0.0 111.07 179.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.603 ' HA ' HD13 ' A' ' 43' ' ' ILE . 3.6 m -61.24 -29.5 45.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 177.392 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.459 ' O ' ' HG3' ' A' ' 77' ' ' GLN . . . -70.32 -28.41 65.14 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.151 179.248 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.606 HG13 ' HA ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -69.87 -36.58 70.06 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.171 0 CA-C-O 120.811 0.338 . . . . 0.0 110.571 179.544 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.825 HD13 ' HB3' ' A' ' 39' ' ' LEU . 0.2 OUTLIER -71.49 -53.99 12.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.134 -179.917 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.459 ' HG3' ' O ' ' A' ' 74' ' ' ALA . 0.0 OUTLIER -52.58 -37.97 59.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.272 0.558 . . . . 0.0 110.283 -179.965 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.11 -21.9 42.73 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.762 178.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.437 ' HB2' ' O ' ' A' ' 75' ' ' VAL . 31.7 t60 . . . . . 0 C--N 1.332 -0.163 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.133 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.83 0.347 . . . . 0.0 110.706 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.727 ' HB2' HD11 ' A' ' 47' ' ' LEU . 7.9 mt -66.7 -69.11 0.33 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.459 179.137 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 7' ' ' ASN . . . . . 0.523 ' HB2' HD13 ' A' ' 47' ' ' LEU . 1.2 t30 -94.68 129.38 36.46 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.961 179.115 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 3.6 Cg_exo -76.49 -4.8 15.46 Favored 'Trans proline' 0 N--CA 1.462 -0.358 0 C-N-CA 122.563 2.175 . . . . 0.0 112.344 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 9' ' ' ASN . . . . . 0.435 ' H ' HD21 ' B' ' 7' ' ' ASN . 72.2 m-20 -123.61 48.7 1.82 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.986 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.44 97.19 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.616 -179.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.516 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -122.71 134.07 54.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.039 178.975 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . 0.58 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 11.5 tt0 -49.17 173.22 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -177.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 13' ' ' PHE . . . . . 0.503 ' CE1' ' HG ' ' A' ' 48' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.52 -0.184 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.712 179.005 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.424 ' HG2' ' NE2' ' A' ' 20' ' ' GLN . 15.9 mttt . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.85 0.357 . . . . 0.0 110.857 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . 0.516 ' CE2' ' HG2' ' B' ' 11' ' ' LYS . 1.1 t80 . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.994 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.78 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 15.0 t . . . . . 0 N--CA 1.455 -0.206 0 CA-C-O 120.597 0.237 . . . . 0.0 110.399 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.445 ' N ' HG22 ' A' ' 8' ' ' THR . . . -59.24 -35.65 74.04 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 176.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 40.7 t -72.91 -34.29 66.52 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.894 177.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.78 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 10.6 mtm -64.15 -35.86 82.17 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.804 177.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.635 HD13 ' HB3' ' A' ' 24' ' ' LEU . 5.6 mp -52.9 -55.63 21.83 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.995 178.273 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.9 -24.73 66.9 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.686 178.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.7 m -101.52 25.07 8.82 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.477 -179.222 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.578 ' HB2' ' HB2' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.889 179.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.578 ' HB2' ' HB2' ' A' ' 15' ' ' ALA . 2.8 mm-40 . . . . . 0 N--CA 1.448 -0.526 0 CA-C-O 120.472 0.177 . . . . 0.0 111.015 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.496 ' O ' HD12 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -46.35 -64.51 0.74 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.894 0.378 . . . . 0.0 110.997 -179.039 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.483 ' H ' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -56.49 -23.14 37.31 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.313 -179.512 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.493 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 2.7 tp60 -73.47 -75.98 0.14 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.771 0.32 . . . . 0.0 111.538 179.555 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' MET . . . . . 0.606 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -68.99 -96.58 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 112.613 0.598 . . . . 0.0 112.613 -176.332 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.635 ' HB3' HD13 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -62.13 3.08 0.19 Allowed 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -175.309 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.49 -117.28 10.29 Favored Glycine 0 N--CA 1.445 -0.761 0 N-CA-C 108.258 -1.937 . . . . 0.0 108.258 -174.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.649 ' HG3' HD23 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -75.49 -69.34 0.49 Allowed 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 168.609 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.755 ' HB2' HD11 ' A' ' 55' ' ' LEU . 9.9 tpt85 -160.44 10.08 0.1 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.188 -1.369 . . . . 0.0 107.768 174.164 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.823 HD23 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.09 -71.62 0.12 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 114.549 -1.205 . . . . 0.0 113.728 -173.14 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.625 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -36.28 -48.92 1.69 Allowed Pre-proline 0 CA--C 1.54 0.583 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -176.24 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.633 ' HB2' ' NH1' ' A' ' 27' ' ' ARG . 42.6 Cg_exo -61.4 -41.12 43.35 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 122.511 2.141 . . . . 0.0 113.874 -178.174 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.785 HD11 ' HA ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -69.98 -45.94 66.25 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.359 0.6 . . . . 0.0 109.556 -179.094 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.737 HD12 ' HB ' ' A' ' 43' ' ' ILE . 0.7 OUTLIER -75.96 -12.09 14.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.021 177.381 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.634 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 3.5 tp-100 -62.44 -38.86 91.4 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.315 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.76 -31.22 70.11 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 174.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' MET . . . . . 0.488 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 5.7 mtt -100.23 27.35 5.72 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.261 178.121 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.634 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -64.92 -32.71 7.04 Favored Pre-proline 0 CA--C 1.536 0.405 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -177.171 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.54 ' CD ' ' N ' ' A' ' 36' ' ' HIS . 61.5 Cg_exo -37.12 -30.39 0.11 Allowed 'Trans proline' 0 C--N 1.36 1.178 0 C-N-CA 122.187 1.925 . . . . 0.0 112.36 179.618 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.524 ' OG1' HG12 ' A' ' 73' ' ' VAL . 37.2 m -78.65 -84.62 0.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.183 177.42 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.657 ' HB3' HD12 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -171.12 49.84 0.03 OUTLIER 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.39 179.219 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.473 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -38.23 -38.11 0.33 Allowed 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.378 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.625 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -51.29 -55.49 19.11 Favored Glycine 0 CA--C 1.518 0.226 0 C-N-CA 121.248 -0.501 . . . . 0.0 113.789 -179.185 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.641 ' HE3' ' HG3' ' B' ' 12' ' ' GLU . 3.5 tptm -77.18 -32.21 55.94 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -177.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.737 ' HB ' HD12 ' A' ' 32' ' ' ILE . 0.5 OUTLIER -54.96 -56.55 10.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.121 -179.255 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.823 ' HA ' HD23 ' A' ' 28' ' ' LEU . 11.8 t -51.37 -44.52 62.13 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.616 179.566 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.75 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -48.63 -68.86 1.13 Allowed Glycine 0 C--O 1.227 -0.297 0 CA-C-N 115.917 -0.583 . . . . 0.0 113.321 -179.376 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.596 ' SD ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.41 -46.76 76.61 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -178.192 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.557 HD11 ' HB2' ' B' ' 7' ' ' ASN . 3.4 mm? -80.31 7.93 8.53 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -178.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.614 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.94 -13.97 60.71 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.86 0.362 . . . . 0.0 110.767 179.894 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.536 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.0 mt-10 -78.6 19.18 0.5 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.731 178.629 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.739 HD13 ' NZ ' ' A' ' 68' ' ' LYS . 1.2 tt -83.22 163.97 2.84 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.982 -179.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.469 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 1.8 m-20 -71.25 156.37 39.62 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.836 -179.108 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.456 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 3.2 m120 -87.12 -28.21 22.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.75 176.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.7 m -74.14 -30.99 62.55 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 176.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.469 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.6 OUTLIER -75.4 -31.17 60.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.31 178.926 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.755 HD11 ' HB2' ' A' ' 27' ' ' ARG . 0.5 OUTLIER -59.28 -45.98 89.77 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.404 179.845 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.447 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 38.6 tp -58.8 -44.24 90.72 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.817 179.438 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.448 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 4.6 m80 -65.04 -38.73 91.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.126 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.801 ' HE1' ' HD3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -60.62 -38.02 83.34 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.101 0.477 . . . . 0.0 110.14 178.828 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.482 HD11 ' NE ' ' A' ' 27' ' ' ARG . 7.6 tt -69.61 -20.25 63.63 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.411 178.837 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.448 ' HG2' ' O ' ' A' ' 57' ' ' HIS . 4.3 pt-20 -106.91 -1.45 22.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.517 -179.34 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.589 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 5.9 m -122.95 78.91 50.52 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.223 -179.556 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.43 ' O ' ' HB2' ' A' ' 66' ' ' ARG . 50.5 Cg_exo -55.69 -33.19 86.67 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.243 1.962 . . . . 0.0 111.993 179.408 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -78.21 -50.39 12.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.824 -179.363 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.589 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 50.2 m -70.43 -51.35 30.04 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.92 0.391 . . . . 0.0 111.535 -177.793 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.67 ' HG ' HD21 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -57.81 -59.33 5.39 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.282 -178.658 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.591 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -52.51 -30.46 30.41 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.796 -178.379 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.524 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.4 OUTLIER -69.44 -38.33 77.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.106 0.479 . . . . 0.0 110.134 178.005 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.801 ' HD3' ' HE1' ' A' ' 58' ' ' MET . 5.7 mtpp -65.65 -59.01 4.38 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.287 178.661 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.755 ' HA ' ' HB1' ' A' ' 72' ' ' ALA . 52.8 t -61.73 -21.53 26.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.606 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.524 ' HB3' ' O ' ' A' ' 67' ' ' SER . 16.2 t70 -54.79 -49.45 70.93 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.416 ' O ' ' HB2' ' A' ' 74' ' ' ALA . 1.1 tp10 -68.84 -30.51 69.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.766 176.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.755 ' HB1' ' HA ' ' A' ' 69' ' ' VAL . . . -57.7 -40.57 79.82 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.105 177.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.524 HG12 ' OG1' ' A' ' 38' ' ' THR . 33.4 t -62.21 -31.11 50.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.526 176.759 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.416 ' HB2' ' O ' ' A' ' 71' ' ' GLU . . . -73.3 -37.14 66.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.53 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.712 HG11 ' HA ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -58.71 -28.17 36.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.963 0.411 . . . . 0.0 110.159 179.782 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.657 HD12 ' HB3' ' A' ' 39' ' ' LEU . 3.1 mm? -71.35 -53.72 13.2 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.876 178.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 20.8 mm100 -51.16 -35.44 35.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.372 179.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.56 -26.92 34.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.877 178.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.47 ' HE2' ' HZ2' ' A' ' 42' ' ' LYS . 6.3 t60 . . . . . 0 C--N 1.332 -0.186 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.162 -179.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 27.5 m-20 . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.809 0.338 . . . . 0.0 110.816 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.18 -85.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.827 179.769 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 7' ' ' ASN . . . . . 0.557 ' HB2' HD11 ' A' ' 47' ' ' LEU . 1.5 t30 -74.46 124.29 89.72 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.816 179.571 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -76.59 -0.74 10.77 Favored 'Trans proline' 0 N--CA 1.463 -0.316 0 C-N-CA 122.138 1.892 . . . . 0.0 111.81 179.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -123.12 51.15 1.47 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.57 179.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.06 97.91 0.05 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.627 -179.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.536 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 2.8 mttp -122.85 138.09 54.75 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.498 178.817 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . 0.641 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 4.9 mp0 -48.43 166.03 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.026 0.441 . . . . 0.0 112.13 -178.841 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 13' ' ' PHE . . . . . 0.75 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.8 OUTLIER . . . . . 0 C--N 1.332 -0.174 0 CA-C-N 115.87 -0.604 . . . . 0.0 109.699 178.726 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.93 0.395 . . . . 0.0 110.775 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.023 -179.28 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.729 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 3.0 t . . . . . 0 CA--C 1.521 -0.155 0 CA-C-O 120.566 0.222 . . . . 0.0 110.624 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.49 -34.92 69.57 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 177.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.3 t -72.22 -36.76 69.23 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.947 177.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.729 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 3.4 mtm -64.59 -37.56 87.99 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.422 178.248 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.574 HD23 ' HB3' ' A' ' 24' ' ' LEU . 65.1 mt -52.76 -50.38 63.62 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.946 179.37 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.39 -26.02 67.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.816 177.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.4 m -101.67 15.19 29.7 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.667 -178.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.71 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 CA--C 1.533 0.323 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.745 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.762 ' HG3' ' HB3' ' A' ' 22' ' ' GLN . 15.7 tp10 . . . . . 0 N--CA 1.456 -0.142 0 CA-C-O 120.773 0.32 . . . . 0.0 110.594 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.607 ' HG2' ' N ' ' A' ' 21' ' ' LYS . 0.1 OUTLIER -50.87 -51.12 54.66 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.326 -179.151 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.607 ' N ' ' HG2' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -56.37 -26.55 53.29 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.514 -178.327 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.762 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 2.5 tp-100 -73.42 -76.65 0.12 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.92 0.391 . . . . 0.0 111.702 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' MET . . . . . 0.72 ' HA ' ' HE3' ' A' ' 11' ' ' MET . 0.0 OUTLIER -68.99 -97.73 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -176.492 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.594 ' HB2' ' CD ' ' A' ' 30' ' ' PRO . 0.4 OUTLIER -59.05 -1.37 0.17 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -176.014 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.54 ' O ' HD21 ' A' ' 24' ' ' LEU . . . 65.06 -118.17 11.69 Favored Glycine 0 N--CA 1.442 -0.901 0 N-CA-C 108.524 -1.83 . . . . 0.0 108.524 -174.764 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.7 ' HG2' HG21 ' A' ' 50' ' ' ILE . 0.4 OUTLIER -76.34 -67.07 0.73 Allowed 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 169.737 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.789 ' HG3' HD23 ' A' ' 31' ' ' LEU . 9.5 tpt180 -160.03 10.11 0.11 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 114.507 -1.224 . . . . 0.0 108.403 177.031 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.693 ' HA ' HD13 ' A' ' 31' ' ' LEU . 4.2 mm? -57.89 -82.41 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.72 -1.127 . . . . 0.0 113.795 -173.005 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.635 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -33.68 -50.0 0.79 Allowed Pre-proline 0 CA--C 1.537 0.471 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -175.071 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.594 ' CD ' ' HB2' ' A' ' 24' ' ' LEU . 12.2 Cg_endo -58.77 -40.6 71.19 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.415 2.076 . . . . 0.0 113.722 -177.612 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.789 HD23 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.52 -47.73 59.01 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 120.077 -0.649 . . . . 0.0 109.79 -179.666 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.772 HG12 HG13 ' A' ' 69' ' ' VAL . 0.3 OUTLIER -73.31 -14.1 16.51 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.156 178.647 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.624 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 55.0 tp60 -62.15 -38.64 89.78 Favored 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 177.016 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.9 -31.1 70.64 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.063 174.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' MET . . . . . 0.632 ' HE2' ' HA ' ' A' ' 66' ' ' ARG . 7.0 mtt -101.24 27.54 6.1 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.317 178.062 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.624 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 2.4 p-80 -64.37 -31.91 6.54 Favored Pre-proline 0 CA--C 1.537 0.458 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 -177.306 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.582 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 49.2 Cg_exo -34.71 -34.96 0.1 OUTLIER 'Trans proline' 0 C--N 1.362 1.257 0 C-N-CA 122.29 1.994 . . . . 0.0 112.411 179.399 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 31.9 m -78.3 -86.52 0.06 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.189 -0.459 . . . . 0.0 109.869 176.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.702 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -171.36 62.32 0.03 OUTLIER 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.364 178.406 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.567 ' HB1' ' O ' ' A' ' 32' ' ' ILE . . . -48.44 -33.29 9.04 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.784 0.326 . . . . 0.0 111.578 179.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.635 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -45.26 -59.41 4.62 Favored Glycine 0 CA--C 1.518 0.24 0 CA-C-N 115.841 -0.618 . . . . 0.0 114.169 -178.262 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.724 ' HZ3' ' HA ' ' B' ' 12' ' ' GLU . 0.1 OUTLIER -78.26 -36.13 47.21 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.332 0.494 . . . . 0.0 112.332 -177.622 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.78 HD12 ' HA ' ' A' ' 73' ' ' VAL . 20.9 mt -53.06 -53.71 20.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.4 -177.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.536 HG23 ' CD2' ' A' ' 29' ' ' PHE . 5.1 t -47.9 -43.04 28.48 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-O 121.153 0.502 . . . . 0.0 109.786 177.736 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.875 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -51.78 -66.38 2.6 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.167 -0.924 . . . . 0.0 113.656 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.667 ' HE2' HG21 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -55.33 -47.45 75.64 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -177.225 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.555 HD13 ' HB2' ' B' ' 6' ' ' LEU . 3.3 mm? -79.98 3.46 20.0 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 121.145 -0.222 . . . . 0.0 111.564 -178.852 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.557 ' O ' HD12 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -66.13 -11.6 50.17 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.842 0.354 . . . . 0.0 110.913 179.991 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -77.85 16.36 0.72 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.967 0.413 . . . . 0.0 110.554 178.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.7 HG21 ' HG2' ' A' ' 26' ' ' GLU . 0.3 OUTLIER -83.77 158.77 3.64 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.048 -179.496 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -71.25 161.7 30.66 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.817 -179.111 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.529 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 1.8 m120 -83.92 -28.6 27.75 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.125 177.777 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.3 t -73.85 -36.67 64.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.081 -0.508 . . . . 0.0 109.961 178.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.409 ' HG2' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -75.71 -23.77 56.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.656 179.548 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.54 ' CD1' ' HB2' ' A' ' 27' ' ' ARG . 0.6 OUTLIER -62.61 -47.15 85.02 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 120.916 0.389 . . . . 0.0 109.967 178.939 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 38.5 tp -58.12 -43.68 87.33 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.526 179.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.484 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 0.4 OUTLIER -57.76 -42.09 83.31 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.804 179.257 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.613 ' SD ' ' HE2' ' A' ' 68' ' ' LYS . 19.9 mmt -60.23 -44.08 95.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.072 0.463 . . . . 0.0 110.329 178.528 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.423 ' HB2' ' HG2' ' A' ' 27' ' ' ARG . 8.4 tp -68.46 -16.29 63.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.777 179.513 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.484 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 0.1 OUTLIER -106.81 0.32 23.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.95 179.51 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.626 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 5.5 m -125.66 82.7 63.29 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.121 -179.591 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -58.32 -35.28 98.87 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.217 1.945 . . . . 0.0 111.935 179.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.443 ' O ' ' HB2' ' A' ' 67' ' ' SER . 31.6 mt-10 -78.3 -47.79 17.06 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.887 -179.21 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.626 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 36.9 m -71.7 -53.12 14.52 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.815 0.34 . . . . 0.0 111.709 -177.779 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.657 HD12 ' HB3' ' A' ' 31' ' ' LEU . 0.1 OUTLIER -57.94 -62.11 2.05 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.302 -178.476 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.632 ' HA ' ' HE2' ' A' ' 35' ' ' MET . 0.6 OUTLIER -50.14 -34.05 20.94 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.861 -178.086 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.459 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.5 OUTLIER -69.6 -38.05 77.15 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.105 0.478 . . . . 0.0 110.228 177.806 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.613 ' HE2' ' SD ' ' A' ' 58' ' ' MET . 0.2 OUTLIER -65.96 -58.2 6.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.316 178.938 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.772 HG13 HG12 ' A' ' 32' ' ' ILE . 28.0 t -62.99 -18.99 22.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.509 179.037 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.653 ' O ' HG21 ' A' ' 73' ' ' VAL . 25.1 t0 -56.14 -49.1 74.88 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 176.374 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.45 ' O ' ' HB2' ' A' ' 74' ' ' ALA . 0.5 OUTLIER -69.08 -24.71 64.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.765 176.481 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.754 ' HB1' ' HA ' ' A' ' 69' ' ' VAL . . . -63.91 -43.85 94.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.811 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.78 ' HA ' HD12 ' A' ' 43' ' ' ILE . 2.5 m -61.35 -29.93 46.95 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 177.15 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.45 ' HB2' ' O ' ' A' ' 71' ' ' GLU . . . -68.41 -38.33 81.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.103 178.82 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.667 HG21 ' HE2' ' A' ' 46' ' ' MET . 1.0 OUTLIER -58.15 -35.44 52.9 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-O 120.995 0.426 . . . . 0.0 110.042 179.221 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.702 ' HG ' ' HB3' ' A' ' 39' ' ' LEU . 2.6 tm? -69.26 -47.06 65.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.065 178.487 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -54.25 -37.26 64.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.652 179.54 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.24 -23.95 37.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.784 178.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 16.0 t-160 . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.992 -179.884 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 24.1 m-20 . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.793 0.33 . . . . 0.0 110.876 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.566 HD11 ' O ' ' A' ' 68' ' ' LYS . 11.9 mt -66.07 -89.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.765 179.72 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 7' ' ' ASN . . . . . 0.511 ' HB2' HD12 ' A' ' 47' ' ' LEU . 0.6 OUTLIER -77.47 119.75 78.7 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.955 179.299 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 9.8 Cg_exo -72.34 0.26 7.66 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.344 2.029 . . . . 0.0 111.953 179.416 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 9' ' ' ASN . . . . . 0.449 ' H ' HD21 ' B' ' 7' ' ' ASN . 17.4 m-80 -123.01 45.55 2.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.605 179.494 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.49 98.45 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.505 -179.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.408 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.4 OUTLIER -117.25 138.16 51.91 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.666 179.185 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . 0.724 ' HA ' ' HZ3' ' A' ' 42' ' ' LYS . 0.4 OUTLIER -50.89 160.82 0.42 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.159 -0.473 . . . . 0.0 112.127 -178.758 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 13' ' ' PHE . . . . . 0.875 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.7 OUTLIER . . . . . 0 N--CA 1.463 0.179 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.472 177.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 12.4 mttm . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.894 0.378 . . . . 0.0 110.93 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . 0.401 ' CE2' ' HB2' ' B' ' 11' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.842 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.748 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 5.2 t . . . . . 0 CA--C 1.522 -0.125 0 CA-C-O 120.746 0.308 . . . . 0.0 110.35 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.4 -37.68 78.62 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 176.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.3 t -66.96 -35.36 79.8 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.805 177.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.748 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.5 mtm -64.46 -38.52 91.3 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.19 178.155 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.768 HD22 ' HB3' ' A' ' 24' ' ' LEU . 49.0 mt -52.29 -44.56 65.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.342 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.27 -34.3 77.68 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.96 178.288 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.4 m -101.75 18.49 20.31 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.676 -179.041 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.631 ' HB3' ' HE1' ' A' ' 23' ' ' MET . . . . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.089 -179.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.51 ' HA ' ' OE1' ' A' ' 19' ' ' GLU . 0.4 OUTLIER . . . . . 0 N--CA 1.455 -0.216 0 CA-C-O 120.592 0.234 . . . . 0.0 110.879 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.678 ' HG2' ' N ' ' A' ' 21' ' ' LYS . 1.6 pm0 -48.64 -51.9 25.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.905 -176.8 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.678 ' N ' ' HG2' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -59.97 -23.29 63.48 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.567 -0.453 . . . . 0.0 111.692 -177.586 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.674 ' N ' ' HD2' ' A' ' 21' ' ' LYS . 5.2 tt0 -73.5 -78.97 0.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.041 0.448 . . . . 0.0 111.682 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' MET . . . . . 0.631 ' HE1' ' HB3' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -69.66 -96.22 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -175.898 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.768 ' HB3' HD22 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -60.77 -2.17 0.51 Allowed 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -174.931 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.556 ' N ' HD21 ' A' ' 24' ' ' LEU . . . 64.65 -116.52 9.11 Favored Glycine 0 N--CA 1.447 -0.576 0 N-CA-C 108.449 -1.861 . . . . 0.0 108.449 -174.488 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.837 ' HG2' HG21 ' A' ' 50' ' ' ILE . 0.3 OUTLIER -76.28 -68.56 0.57 Allowed 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 168.646 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.718 ' HE ' HD12 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -159.92 9.03 0.1 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.176 -1.374 . . . . 0.0 108.022 174.445 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.832 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.03 -74.39 0.07 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.139 -1.391 . . . . 0.0 113.896 -172.982 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.645 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -35.38 -49.14 1.26 Allowed Pre-proline 0 CA--C 1.538 0.504 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -175.646 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.558 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 52.0 Cg_exo -58.83 -43.35 44.55 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 122.316 2.011 . . . . 0.0 113.648 -178.722 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.786 HD11 HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.54 -47.2 61.52 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 120.269 -0.572 . . . . 0.0 110.002 -178.509 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.771 HD11 ' HB ' ' A' ' 43' ' ' ILE . 0.6 OUTLIER -73.43 -12.93 15.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.909 178.073 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.606 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.7 OUTLIER -62.19 -38.54 89.51 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 177.147 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.56 -31.4 70.58 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.039 174.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' MET . . . . . 0.552 ' SD ' HG13 ' A' ' 69' ' ' VAL . 6.6 mtt -100.84 27.99 5.55 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.228 178.061 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.606 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 3.7 p-80 -64.9 -31.69 5.77 Favored Pre-proline 0 CA--C 1.536 0.407 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 -177.232 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.544 ' HD3' ' ND1' ' A' ' 36' ' ' HIS . 63.0 Cg_exo -37.75 -29.97 0.13 Allowed 'Trans proline' 0 C--N 1.362 1.286 0 C-N-CA 122.137 1.891 . . . . 0.0 112.278 179.236 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.581 HG22 HG12 ' A' ' 73' ' ' VAL . 6.4 m -78.14 -86.11 0.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.04 177.137 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.476 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.3 OUTLIER -171.39 50.52 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.488 -0.323 . . . . 0.0 111.246 178.642 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.512 ' HB1' ' O ' ' A' ' 32' ' ' ILE . . . -37.78 -36.84 0.2 Allowed 'General case' 0 N--CA 1.467 0.413 0 O-C-N 123.312 0.382 . . . . 0.0 111.92 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.645 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.34 -60.1 5.97 Favored Glycine 0 C--N 1.329 0.173 0 CA-C-N 116.042 -0.526 . . . . 0.0 113.821 -179.409 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.476 ' HG3' ' SD ' ' A' ' 46' ' ' MET . 0.4 OUTLIER -77.32 -30.47 54.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.983 0.392 . . . . 0.0 111.989 -177.681 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.771 ' HB ' HD11 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -54.0 -54.95 16.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 C-N-CA 121.077 -0.249 . . . . 0.0 111.155 -179.281 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.832 ' HA ' HD22 ' A' ' 28' ' ' LEU . 10.7 t -51.56 -47.57 63.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.628 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.557 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -49.8 -59.76 7.08 Favored Glycine 0 CA--C 1.518 0.264 0 C-N-CA 121.161 -0.543 . . . . 0.0 113.309 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.518 ' HB3' ' HB3' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -56.32 -53.79 53.08 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.788 0.294 . . . . 0.0 111.475 -178.731 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.436 HD22 ' N ' ' A' ' 47' ' ' LEU . 2.9 mm? -80.02 10.19 4.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.819 -178.414 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.557 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.99 -17.62 64.8 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.872 0.368 . . . . 0.0 110.731 179.602 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.479 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.0 mm-40 -74.79 17.74 0.2 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.862 179.465 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.837 HG21 ' HG2' ' A' ' 26' ' ' GLU . 0.1 OUTLIER -83.98 160.08 3.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.88 -179.977 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.475 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 1.5 m-20 -70.71 156.82 39.01 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -178.334 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.625 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 2.2 m120 -84.21 -29.62 26.41 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.237 178.153 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.9 m -74.22 -35.18 63.88 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.422 0.629 . . . . 0.0 109.594 177.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.475 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -76.58 -21.6 55.39 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.688 179.657 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.652 HD23 ' HG3' ' A' ' 26' ' ' GLU . 0.9 OUTLIER -65.66 -47.54 75.16 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-O 121.001 0.429 . . . . 0.0 110.04 178.782 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 tt -56.18 -44.31 79.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.685 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -56.61 -39.65 73.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.568 -179.503 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.524 ' HE2' ' HA ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -57.36 -52.82 63.81 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -178.815 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.718 HD12 ' HE ' ' A' ' 27' ' ' ARG . 0.5 OUTLIER -61.53 -19.69 62.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.736 0.303 . . . . 0.0 111.171 -179.364 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -102.57 -6.22 23.05 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.603 178.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.546 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 52.4 m -122.72 81.76 48.65 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.729 -179.757 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.411 ' O ' ' HB2' ' A' ' 66' ' ' ARG . 19.6 Cg_endo -58.01 -30.57 90.45 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.338 2.026 . . . . 0.0 112.189 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -78.4 -50.5 11.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.954 -179.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.419 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 73.1 m -74.6 -29.67 61.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.967 -177.539 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.786 HD22 HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -78.68 -60.03 2.54 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.006 -178.329 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.528 ' N ' HD11 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -53.6 -31.72 48.13 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.636 -0.425 . . . . 0.0 110.539 -178.674 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.469 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 3.0 m -67.82 -36.53 80.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.096 177.687 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.482 ' HE2' ' HE3' ' A' ' 58' ' ' MET . 0.3 OUTLIER -65.31 -60.1 3.35 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.973 178.399 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.681 ' HA ' ' HB3' ' A' ' 72' ' ' ALA . 69.5 t -64.16 -19.71 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.731 -179.629 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.469 ' HB3' ' O ' ' A' ' 67' ' ' SER . 10.9 t70 -55.25 -50.67 68.89 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 176.84 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.429 ' O ' HG12 ' A' ' 75' ' ' VAL . 0.4 OUTLIER -69.22 -30.69 68.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.773 176.777 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.681 ' HB3' ' HA ' ' A' ' 69' ' ' VAL . . . -57.29 -42.41 81.64 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.307 178.299 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.581 HG12 HG22 ' A' ' 38' ' ' THR . 20.9 t -61.8 -31.12 50.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 176.888 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.51 -37.0 65.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.54 179.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.672 HG11 ' HA ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.64 -27.81 35.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-O 120.95 0.405 . . . . 0.0 110.207 179.803 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.708 HD21 HG12 ' A' ' 43' ' ' ILE . 3.0 mm? -71.68 -54.85 9.01 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.639 178.526 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 64.3 mm-40 -51.18 -33.23 26.31 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.372 179.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.28 -32.76 33.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.745 178.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 71.2 t60 . . . . . 0 C--N 1.331 -0.207 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.873 179.976 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 25.7 m120 . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.802 0.334 . . . . 0.0 110.847 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.3 mt -73.11 -78.5 0.09 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.678 179.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 7' ' ' ASN . . . . . 0.498 HD21 ' H ' ' B' ' 9' ' ' ASN . 0.8 OUTLIER -84.0 125.18 73.42 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.022 179.815 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -77.78 0.54 9.73 Favored 'Trans proline' 0 N--CA 1.461 -0.406 0 C-N-CA 122.195 1.93 . . . . 0.0 112.038 178.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 9' ' ' ASN . . . . . 0.612 ' HB3' ' HZ1' ' B' ' 11' ' ' LYS . 55.9 m-80 -123.44 49.63 1.68 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.796 179.66 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . 0.518 ' HB3' ' HB3' ' A' ' 46' ' ' MET . . . -60.66 97.57 0.06 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.576 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.612 ' HZ1' ' HB3' ' B' ' 9' ' ' ASN . 0.3 OUTLIER -117.41 167.71 11.02 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.478 178.559 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -67.25 167.93 11.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.691 0.281 . . . . 0.0 110.86 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 13' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.332 -0.169 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.855 -179.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.634 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 3.4 mttt . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.77 0.319 . . . . 0.0 110.842 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.95 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.793 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 5.0 t . . . . . 0 CA--C 1.52 -0.182 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.39 -40.8 87.75 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 176.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 37.4 t -67.8 -34.6 77.09 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.555 177.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.793 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.7 mtm -64.37 -39.3 93.6 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.264 177.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.78 HD22 ' HB3' ' A' ' 24' ' ' LEU . 45.5 mt -52.3 -45.67 65.63 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.274 -179.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.15 -34.04 77.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.994 178.305 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 37.3 m -101.87 21.65 14.27 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.594 -178.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.554 ' HB3' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.33 -0.253 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.159 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.554 ' HB3' ' HB3' ' A' ' 15' ' ' ALA . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.71 0.291 . . . . 0.0 110.756 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.746 HE22 ' HB3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -48.19 -62.88 1.26 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.347 -179.735 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.729 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -55.7 -23.37 28.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.703 -178.103 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.612 ' HB2' ' HZ1' ' A' ' 21' ' ' LYS . 15.8 tt0 -73.08 -79.15 0.08 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.894 0.378 . . . . 0.0 111.766 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' MET . . . . . 0.421 ' H ' ' HG3' ' A' ' 23' ' ' MET . 0.0 OUTLIER -69.46 -95.9 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -176.602 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.78 ' HB3' HD22 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -59.77 -1.56 0.28 Allowed 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -175.428 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.52 ' O ' HD21 ' A' ' 24' ' ' LEU . . . 65.08 -116.05 8.45 Favored Glycine 0 N--CA 1.445 -0.733 0 N-CA-C 108.548 -1.821 . . . . 0.0 108.548 -174.374 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.702 ' HG3' HD23 ' A' ' 55' ' ' LEU . 0.5 OUTLIER -75.85 -68.51 0.57 Allowed 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 168.941 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.749 ' HG2' HD12 ' A' ' 59' ' ' LEU . 10.7 tpt180 -159.89 7.69 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 114.136 -1.393 . . . . 0.0 107.794 175.332 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.875 ' HA ' HD11 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -60.71 -71.98 0.12 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.236 -1.347 . . . . 0.0 113.93 -173.414 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.624 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -35.5 -48.12 1.24 Allowed Pre-proline 0 CA--C 1.541 0.603 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -175.926 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.599 ' CD ' ' HB2' ' A' ' 24' ' ' LEU . 20.9 Cg_endo -64.18 -39.11 32.39 Favored 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 122.201 1.934 . . . . 0.0 113.573 -178.027 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.875 HD11 ' HA ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -70.14 -45.92 65.83 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.764 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.767 HD11 ' HB ' ' A' ' 43' ' ' ILE . 0.6 OUTLIER -74.24 -13.72 15.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.932 177.6 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.551 ' HB3' ' O ' ' A' ' 30' ' ' PRO . 1.4 tt0 -62.27 -38.19 88.37 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 177.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.04 -31.0 68.41 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 175.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' MET . . . . . 0.534 ' HE2' ' HA ' ' A' ' 66' ' ' ARG . 4.8 mtt -100.34 27.15 5.91 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.026 177.886 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.793 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 8.5 p-80 -66.32 -30.84 3.83 Favored Pre-proline 0 CA--C 1.536 0.439 0 N-CA-C 113.719 1.007 . . . . 0.0 113.719 -176.438 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.793 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 4.1 Cg_exo -39.19 -28.93 0.18 Allowed 'Trans proline' 0 C--N 1.361 1.203 0 C-N-CA 122.271 1.981 . . . . 0.0 112.098 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.658 HG22 HG11 ' A' ' 73' ' ' VAL . 32.9 m -78.43 -83.85 0.08 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.393 177.637 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.46 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.2 OUTLIER -171.09 48.21 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.369 179.277 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.498 ' HB1' ' O ' ' A' ' 32' ' ' ILE . . . -37.41 -37.85 0.21 Allowed 'General case' 0 N--CA 1.469 0.477 0 O-C-N 123.307 0.379 . . . . 0.0 111.975 -179.406 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.624 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.2 -59.76 6.13 Favored Glycine 0 C--N 1.33 0.235 0 CA-C-N 116.139 -0.482 . . . . 0.0 113.815 -179.259 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.752 ' HB3' HD13 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -77.49 -30.99 53.35 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.106 0.409 . . . . 0.0 112.106 -177.587 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.767 ' HB ' HD11 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -54.09 -56.24 10.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.113 -179.249 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.744 ' HA ' HD22 ' A' ' 28' ' ' LEU . 9.1 t -47.89 -49.34 30.04 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.083 -179.381 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.558 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -49.56 -61.94 5.19 Favored Glycine 0 CA--C 1.521 0.423 0 C-N-CA 121.153 -0.546 . . . . 0.0 113.595 -179.375 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.586 ' SD ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.2 -62.87 1.38 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.815 0.307 . . . . 0.0 111.827 -177.79 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.723 HD13 ' HB2' ' B' ' 7' ' ' ASN . 1.6 mm? -70.17 1.74 4.43 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 -177.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.709 ' HA ' HD11 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -66.52 -8.76 28.78 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.942 -0.303 . . . . 0.0 111.161 179.924 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.493 ' HG3' ' O ' ' B' ' 9' ' ' ASN . 2.7 mm-40 -74.65 16.14 0.3 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.414 0.626 . . . . 0.0 109.531 176.755 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.587 HD12 ' HZ3' ' A' ' 68' ' ' LYS . 0.2 OUTLIER -82.41 162.94 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.558 -179.833 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.493 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 3.5 m-20 -70.7 160.8 31.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.9 0.381 . . . . 0.0 111.873 -178.728 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.591 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 4.4 m120 -89.12 -29.35 19.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.689 177.272 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -73.9 -30.72 62.76 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 176.768 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.493 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.1 OUTLIER -78.22 -28.87 48.04 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.675 178.981 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.702 HD23 ' HG3' ' A' ' 26' ' ' GLU . 0.9 OUTLIER -58.69 -44.84 90.41 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 179.428 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.675 ' HA ' HD13 ' A' ' 59' ' ' LEU . 8.0 tt -57.74 -49.18 77.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.37 177.779 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -57.06 -22.64 40.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.685 -179.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.652 ' HB3' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -71.27 -53.67 13.52 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -178.754 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.823 HD11 ' H ' ' A' ' 59' ' ' LEU . 0.0 OUTLIER -68.11 -7.39 29.25 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 119.997 -0.681 . . . . 0.0 110.691 179.891 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 56' ' ' LEU . 4.9 mt-10 -99.46 -11.38 21.15 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.926 176.237 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.538 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 3.4 m -122.32 85.56 47.43 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.184 -179.026 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -62.51 -33.4 78.77 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.186 1.924 . . . . 0.0 111.65 178.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -78.44 -47.02 18.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.485 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.498 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 1.9 m -71.37 -54.9 9.19 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.917 0.389 . . . . 0.0 111.58 -178.304 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.754 HD12 ' HB3' ' A' ' 31' ' ' LEU . 0.2 OUTLIER -58.21 -62.16 2.03 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.707 -177.805 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.534 ' HA ' ' HE2' ' A' ' 35' ' ' MET . 1.5 ttm180 -50.47 -37.16 36.94 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.746 -0.381 . . . . 0.0 111.345 -177.374 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.591 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 1.4 t -69.47 -34.53 74.5 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.312 0.577 . . . . 0.0 110.172 178.144 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.587 ' HZ3' HD12 ' A' ' 50' ' ' ILE . 3.0 ttpp -65.91 -57.23 8.33 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.161 178.716 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.763 HG11 HG12 ' A' ' 32' ' ' ILE . 37.1 t -64.93 -18.89 24.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.25 178.457 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.591 ' HB3' ' O ' ' A' ' 67' ' ' SER . 25.6 t70 -54.29 -48.72 70.96 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 176.727 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -66.08 -35.17 79.79 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.682 176.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.765 ' HA ' HG11 ' A' ' 75' ' ' VAL . . . -55.33 -40.74 71.57 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.35 178.044 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.658 HG11 HG22 ' A' ' 38' ' ' THR . 9.9 t -60.7 -34.21 57.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.026 177.516 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.38 -35.09 65.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.696 -179.543 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.765 HG11 ' HA ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -57.35 -29.68 33.68 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-O 121.019 0.438 . . . . 0.0 109.899 179.53 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.752 HD13 ' HB3' ' A' ' 42' ' ' LYS . 3.7 mm? -71.93 -54.95 8.43 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.772 178.11 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -50.91 -33.81 25.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.252 179.65 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.54 -32.59 32.18 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.662 177.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 84.1 t60 . . . . . 0 C--N 1.331 -0.222 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.077 -179.834 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 2.8 m120 . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.809 0.338 . . . . 0.0 110.977 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.494 HD21 ' O ' ' A' ' 68' ' ' LYS . 7.2 tp -69.58 -72.76 0.18 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.09 -179.769 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 7' ' ' ASN . . . . . 0.723 ' HB2' HD13 ' A' ' 47' ' ' LEU . 1.8 t30 -88.95 130.24 45.39 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.985 179.668 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 3.4 Cg_exo -76.66 -0.76 10.82 Favored 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 122.476 2.117 . . . . 0.0 112.007 179.347 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 9' ' ' ASN . . . . . 0.493 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 68.9 m-20 -123.23 48.06 1.89 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.005 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.37 99.15 0.07 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.812 -179.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.454 ' O ' ' HA ' ' A' ' 46' ' ' MET . 0.0 OUTLIER -122.37 153.58 38.83 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.679 178.407 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . 0.554 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 5.7 tt0 -55.4 169.85 0.27 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.916 0.388 . . . . 0.0 111.511 -179.464 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 13' ' ' PHE . . . . . 0.452 ' CZ ' HD12 ' A' ' 48' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.129 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.581 179.554 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.746 ' HB3' HE22 ' A' ' 20' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.877 0.37 . . . . 0.0 110.716 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.984 -179.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.738 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 8.9 t . . . . . 0 CA--C 1.522 -0.126 0 CA-C-O 120.566 0.222 . . . . 0.0 110.89 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.537 ' HB1' HE21 ' A' ' 33' ' ' GLN . . . -59.09 -37.11 76.36 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 177.381 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.4 t -70.45 -34.01 71.96 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.884 177.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.738 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 11.8 mtm -64.29 -36.41 84.02 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 177.63 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.593 HD12 ' HB3' ' A' ' 24' ' ' LEU . 2.0 mp -52.12 -52.47 51.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.996 178.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.33 -28.7 68.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.233 178.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.2 p -101.4 17.73 21.92 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.953 -178.097 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.499 ' HB2' ' O ' ' A' ' 11' ' ' MET . . . . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.696 -0.229 . . . . 0.0 111.0 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.529 ' HA ' ' OE1' ' A' ' 19' ' ' GLU . 0.5 OUTLIER . . . . . 0 N--CA 1.455 -0.224 0 CA-C-O 120.654 0.264 . . . . 0.0 111.11 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.531 HE21 ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -46.52 -60.5 2.32 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.745 -177.812 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.608 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -56.05 -22.38 27.19 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.913 -177.617 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.608 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 5.9 tt0 -73.37 -78.76 0.09 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.013 0.435 . . . . 0.0 111.428 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' MET . . . . . 0.613 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.3 -97.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.68 -176.396 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.613 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -59.62 -2.19 0.33 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -175.714 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.459 ' HA3' HD23 ' A' ' 48' ' ' LEU . . . 65.21 -115.55 7.85 Favored Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 108.672 -1.771 . . . . 0.0 108.672 -174.426 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.612 ' HG3' HD21 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -75.8 -69.65 0.48 Allowed 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 169.386 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.7 ' HG2' HD23 ' A' ' 59' ' ' LEU . 4.8 tpt180 -159.48 13.01 0.14 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.377 -1.283 . . . . 0.0 108.156 175.48 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.461 HD23 ' N ' ' A' ' 28' ' ' LEU . 4.2 mm? -57.41 -83.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.56 -1.2 . . . . 0.0 113.809 -173.187 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.614 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -33.04 -51.47 0.66 Allowed Pre-proline 0 CA--C 1.536 0.404 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 -174.846 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.58 ' HG2' ' O ' ' A' ' 27' ' ' ARG . 10.5 Cg_endo -56.39 -42.0 70.42 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.394 2.062 . . . . 0.0 113.646 -177.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.84 -48.26 54.91 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 120.128 -0.629 . . . . 0.0 109.893 -179.665 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.782 HG12 HG11 ' A' ' 69' ' ' VAL . 0.5 OUTLIER -71.33 -14.1 17.51 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.626 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.037 178.424 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.646 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 1.3 tp-100 -62.19 -39.29 92.23 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.196 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.77 -29.87 69.94 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.257 -0.883 . . . . 0.0 108.964 174.479 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' MET . . . . . 0.673 ' SD ' HG13 ' A' ' 69' ' ' VAL . 7.7 mtt -101.99 26.14 7.91 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.349 178.184 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.646 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -64.33 -31.98 6.69 Favored Pre-proline 0 CA--C 1.535 0.392 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -177.897 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.568 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 51.0 Cg_exo -35.0 -34.36 0.1 OUTLIER 'Trans proline' 0 C--N 1.364 1.365 0 C-N-CA 122.16 1.907 . . . . 0.0 112.008 178.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 20.5 m -78.19 -89.63 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 175.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.836 ' HB3' HD12 ' A' ' 76' ' ' LEU . 3.1 tp -171.93 67.63 0.04 OUTLIER 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.427 177.448 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.467 ' CB ' ' HB ' ' A' ' 32' ' ' ILE . . . -50.24 -24.5 2.92 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.804 0.335 . . . . 0.0 111.573 179.542 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.614 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -49.89 -62.98 4.53 Favored Glycine 0 CA--C 1.518 0.265 0 CA-C-N 115.965 -0.562 . . . . 0.0 114.298 -178.177 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.526 ' HG3' ' SD ' ' A' ' 46' ' ' MET . 2.4 tptm -77.42 -32.79 54.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 117.169 0.484 . . . . 0.0 112.03 -177.328 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.675 HD13 ' HA ' ' A' ' 73' ' ' VAL . 18.7 mt -54.21 -55.95 12.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.729 -0.214 . . . . 0.0 111.427 -178.822 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.567 HG23 ' CD2' ' A' ' 29' ' ' PHE . 4.7 t -47.69 -46.86 29.82 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.887 0.375 . . . . 0.0 110.473 179.077 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.702 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -54.44 -61.95 6.7 Favored Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 115.73 -0.668 . . . . 0.0 113.551 -179.559 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.526 ' SD ' ' HG3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.73 -48.07 75.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.859 0.329 . . . . 0.0 111.414 -178.322 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.603 HD13 ' HB2' ' B' ' 7' ' ' ASN . 3.2 mm? -80.1 2.43 24.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.439 -179.493 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.506 ' O ' HD12 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -65.93 -12.41 54.53 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.979 0.418 . . . . 0.0 110.392 179.333 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -78.95 17.85 0.69 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.277 177.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.483 HG21 ' HG2' ' A' ' 26' ' ' GLU . 0.6 OUTLIER -83.58 162.74 3.07 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.876 -179.53 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.429 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 1.8 m-20 -70.76 158.84 35.6 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.769 -178.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.722 ' HA ' HD21 ' A' ' 55' ' ' LEU . 4.7 m120 -83.58 -28.28 28.65 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.788 177.178 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.569 ' HA ' HD21 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -74.51 -32.03 62.37 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.408 0.623 . . . . 0.0 109.902 177.419 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.429 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 1.0 OUTLIER -77.84 -26.61 49.53 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.483 178.92 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.722 HD21 ' HA ' ' A' ' 52' ' ' ASN . 0.5 OUTLIER -62.48 -49.66 74.53 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.654 179.984 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.774 ' HA ' HD21 ' A' ' 59' ' ' LEU . 0.4 OUTLIER -59.59 -40.98 89.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.985 -179.441 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 3.3 m-70 -63.06 -20.61 65.5 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.634 -179.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.693 ' HE3' ' HA ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -76.89 -60.0 2.54 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -178.77 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.774 HD21 ' HA ' ' A' ' 56' ' ' LEU . 2.5 pt? -66.69 -4.06 8.04 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.375 179.662 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.44 ' HB3' ' O ' ' A' ' 56' ' ' LEU . 1.3 tt0 -104.24 -19.12 14.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.894 177.663 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.449 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 0.5 OUTLIER -122.52 87.14 49.08 Favored Pre-proline 0 C--O 1.223 -0.334 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.134 179.398 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -54.3 -34.11 78.74 Favored 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.469 2.113 . . . . 0.0 112.661 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.645 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.0 -48.7 15.59 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.617 -178.998 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.645 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 23.3 m -72.73 -26.68 61.67 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.176 0.512 . . . . 0.0 111.098 -179.193 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.693 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 0.2 OUTLIER -77.8 -65.79 0.92 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.155 -178.6 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.499 ' HA ' ' HE3' ' A' ' 35' ' ' MET . 0.3 OUTLIER -49.75 -28.39 6.11 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.807 -177.854 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.447 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.5 OUTLIER -68.64 -39.56 80.68 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.25 178.348 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.435 ' O ' HD12 ' B' ' 6' ' ' LEU . 0.2 OUTLIER -65.03 -59.91 3.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.211 178.918 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.782 HG11 HG12 ' A' ' 32' ' ' ILE . 54.4 t -63.15 -20.51 26.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.007 -179.426 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.545 ' O ' HG21 ' A' ' 73' ' ' VAL . 23.8 t70 -55.07 -49.72 70.94 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 176.726 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.572 ' HG2' ' HB3' ' B' ' 5' ' ' ASN . 49.1 tt0 -68.97 -26.67 65.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.801 176.834 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.769 ' HB1' ' HA ' ' A' ' 69' ' ' VAL . . . -62.63 -51.84 65.69 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.367 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.675 ' HA ' HD13 ' A' ' 43' ' ' ILE . 5.3 m -56.73 -28.43 27.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.161 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 177.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.527 ' O ' ' HG3' ' A' ' 77' ' ' GLN . . . -72.59 -30.62 64.53 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.342 179.33 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.731 HG13 ' HA ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -67.44 -37.41 78.86 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.189 0 CA-C-O 120.791 0.329 . . . . 0.0 110.532 179.617 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.836 HD12 ' HB3' ' A' ' 39' ' ' LEU . 0.3 OUTLIER -71.87 -52.7 16.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.945 179.548 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.527 ' HG3' ' O ' ' A' ' 74' ' ' ALA . 1.5 pp0? -56.05 -35.18 66.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.121 0.486 . . . . 0.0 109.997 179.556 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.91 -21.09 40.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.613 178.004 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 11.3 t-160 . . . . . 0 C--N 1.331 -0.207 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.718 179.452 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 5' ' ' ASN . . . . . 0.572 ' HB3' ' HG2' ' A' ' 71' ' ' GLU . 2.0 m-20 . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.793 0.33 . . . . 0.0 110.929 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.435 HD12 ' O ' ' A' ' 68' ' ' LYS . 1.9 mt -67.52 -82.85 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.795 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 7' ' ' ASN . . . . . 0.603 ' HB2' HD13 ' A' ' 47' ' ' LEU . 1.6 t30 -74.66 124.18 89.53 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.917 179.758 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.26 1.98 7.73 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.18 1.92 . . . . 0.0 111.791 178.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 9' ' ' ASN . . . . . 0.673 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 22.8 m120 -123.23 48.54 1.81 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.7 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.33 98.5 0.06 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.708 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.673 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 19.9 mmtp -122.88 153.09 40.1 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.323 178.204 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -55.26 165.0 0.81 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.863 0.363 . . . . 0.0 111.12 -179.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 13' ' ' PHE . . . . . 0.702 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.2 t80 . . . . . 0 C--N 1.331 -0.231 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.741 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.443 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.46 0.074 0 CA-C-O 120.693 0.282 . . . . 0.0 110.862 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.331 -0.223 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.013 -179.957 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.754 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 6.9 t . . . . . 0 CA--C 1.523 -0.086 0 CA-C-O 120.537 0.208 . . . . 0.0 110.647 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.41 -35.63 74.34 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 177.341 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 5.5 t -71.23 -34.69 71.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.737 177.365 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.754 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.0 mtm -64.23 -36.25 83.48 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.85 177.692 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.712 HD13 ' HB3' ' A' ' 24' ' ' LEU . 1.9 mp -52.41 -53.53 43.91 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.895 178.768 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.42 -26.74 67.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.976 178.268 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.4 22.84 11.92 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.778 -178.654 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.453 ' HB2' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 CA--C 1.533 0.312 0 CA-C-O 120.611 0.243 . . . . 0.0 111.065 179.81 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.456 ' O ' ' HB3' ' A' ' 22' ' ' GLN . 0.9 OUTLIER . . . . . 0 N--CA 1.453 -0.28 0 CA-C-O 120.837 0.351 . . . . 0.0 110.608 . . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.412 ' HA ' HD21 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -53.11 -63.25 1.21 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.637 -179.565 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.45 ' H ' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -56.17 -21.35 22.35 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.2 -179.087 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.456 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 2.1 tp-100 -73.55 -81.04 0.07 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.973 0.416 . . . . 0.0 111.667 179.571 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' MET . . . . . 0.733 ' HA ' ' HE2' ' A' ' 11' ' ' MET . 0.0 OUTLIER -69.67 -97.11 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -176.272 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.712 ' HB3' HD13 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -56.93 0.71 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -175.183 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.505 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 65.12 -117.51 10.44 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 108.481 -1.848 . . . . 0.0 108.481 -174.783 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.8 ' HG3' HD22 ' A' ' 55' ' ' LEU . 0.3 OUTLIER -75.54 -68.03 0.61 Allowed 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 168.715 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.821 ' HG3' HD23 ' A' ' 31' ' ' LEU . 1.0 OUTLIER -160.51 7.69 0.09 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.121 -1.4 . . . . 0.0 107.914 174.784 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.818 HD23 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.73 -73.21 0.09 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.387 -1.279 . . . . 0.0 114.139 -173.064 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.635 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -36.46 -49.23 1.81 Allowed Pre-proline 0 CA--C 1.536 0.426 0 N-CA-C 113.612 0.968 . . . . 0.0 113.612 -175.789 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.587 ' HG3' ' HB2' ' A' ' 24' ' ' LEU . 18.9 Cg_endo -61.76 -39.33 53.56 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 122.19 1.926 . . . . 0.0 113.593 -177.41 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.821 HD23 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.15 -46.95 60.49 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 120.26 -0.576 . . . . 0.0 110.087 -179.496 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.716 HG12 HG12 ' A' ' 69' ' ' VAL . 0.7 OUTLIER -72.31 -17.71 18.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.294 -0.412 . . . . 0.0 109.925 177.71 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.641 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 1.0 OUTLIER -63.36 -31.98 73.28 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 176.286 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.25 -27.77 61.76 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 175.011 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' MET . . . . . 0.561 ' HE3' HG11 ' A' ' 69' ' ' VAL . 12.2 mtt -99.97 16.82 22.67 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 114.862 -1.063 . . . . 0.0 109.655 177.17 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.805 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 0.4 OUTLIER -63.45 -34.81 13.95 Favored Pre-proline 0 CA--C 1.534 0.345 0 CA-C-N 115.379 -0.828 . . . . 0.0 112.011 -179.235 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.805 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 2.2 Cg_endo -39.87 -30.05 0.35 Allowed 'Trans proline' 0 C--N 1.364 1.369 0 C-N-CA 122.106 1.871 . . . . 0.0 110.713 177.386 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.512 HG23 ' CG1' ' A' ' 73' ' ' VAL . 0.2 OUTLIER -78.18 -84.38 0.08 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.209 175.161 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.724 HD23 HD22 ' A' ' 76' ' ' LEU . 11.7 tp -172.15 63.41 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 177.603 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.34 -176.02 0.06 Allowed 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 175.736 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.635 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . 103.91 -69.21 0.28 Allowed Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.292 -0.956 . . . . 0.0 113.112 179.664 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.677 ' HE3' ' HG2' ' B' ' 12' ' ' GLU . 1.0 OUTLIER -77.25 -34.97 55.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.825 0.345 . . . . 0.0 111.04 -179.655 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.653 ' HB ' HD13 ' A' ' 32' ' ' ILE . 17.6 mt -54.08 -53.03 31.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.108 -179.39 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.818 ' HA ' HD23 ' A' ' 28' ' ' LEU . 8.9 t -54.65 -43.75 72.63 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-O 120.9 0.381 . . . . 0.0 110.313 178.22 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.778 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -48.11 -61.27 5.02 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.573 -0.74 . . . . 0.0 113.457 -178.769 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.688 ' SD ' HG23 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -61.8 -50.08 73.78 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -177.757 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.602 HD12 ' H ' ' B' ' 7' ' ' ASN . 4.0 mm? -78.75 11.05 2.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.602 0.239 . . . . 0.0 111.493 -179.018 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.61 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -63.79 -29.44 70.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.295 -179.186 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.32 29.02 0.15 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.772 0.32 . . . . 0.0 110.921 179.094 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.552 HG21 ' HG2' ' A' ' 26' ' ' GLU . 2.5 tt -82.77 169.78 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.365 179.081 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.553 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 16.8 m-20 -67.54 137.59 55.86 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.537 -179.0 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.712 ' HA ' HD22 ' A' ' 55' ' ' LEU . 4.9 m120 -76.51 -27.71 56.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.171 0.51 . . . . 0.0 109.642 177.198 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 42.6 m -74.05 -31.27 62.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.639 177.437 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.553 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 2.2 mm-40 -77.51 -29.89 52.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.668 178.925 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.8 HD22 ' HG3' ' A' ' 26' ' ' GLU . 0.6 OUTLIER -58.85 -46.73 87.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.284 -179.953 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.438 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 33.1 tp -61.64 -43.6 98.55 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.409 178.843 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 28.8 m80 -66.93 -19.41 65.72 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.982 179.79 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.575 ' HE2' ' HD3' ' A' ' 68' ' ' LYS . 17.9 mmt -72.4 -47.51 48.65 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.988 -179.983 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.633 HD22 ' NE ' ' A' ' 27' ' ' ARG . 0.2 OUTLIER -66.33 -20.91 66.22 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.229 -179.831 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -96.54 -7.54 34.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.716 0.293 . . . . 0.0 111.576 -179.316 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.617 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -122.88 88.39 50.51 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.891 -179.951 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -62.63 -32.1 79.24 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.302 2.001 . . . . 0.0 112.052 179.552 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -78.06 -48.84 15.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.498 -179.776 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 26.1 m -69.49 -48.8 59.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.394 -178.376 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.617 ' HB3' ' O ' ' A' ' 61' ' ' SER . 0.9 OUTLIER -59.75 -64.83 0.81 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.874 -178.662 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.604 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.5 OUTLIER -50.1 -29.38 8.88 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.068 -177.215 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -63.75 -43.96 94.91 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.078 0.466 . . . . 0.0 110.229 178.134 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.575 ' HD3' ' HE2' ' A' ' 58' ' ' MET . 25.6 mtpt -66.16 -60.68 2.57 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.937 179.327 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.764 ' HA ' ' HB1' ' A' ' 72' ' ' ALA . 75.6 t -61.13 -23.18 29.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.194 -178.542 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.429 ' HB2' ' O ' ' A' ' 66' ' ' ARG . 24.8 t70 -55.58 -49.95 71.37 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 176.612 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.639 ' HG2' ' HB3' ' B' ' 5' ' ' ASN . 0.5 OUTLIER -68.9 -28.16 66.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.69 176.542 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.764 ' HB1' ' HA ' ' A' ' 69' ' ' VAL . . . -59.83 -37.66 79.84 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.068 177.933 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.512 ' CG1' HG23 ' A' ' 38' ' ' THR . 28.4 t -66.43 -29.63 47.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 176.975 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.11 -40.39 71.51 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.292 179.46 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.688 HG23 ' SD ' ' A' ' 46' ' ' MET . 0.9 OUTLIER -54.55 -39.33 45.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-O 120.96 0.41 . . . . 0.0 110.222 179.385 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.724 HD22 HD23 ' A' ' 39' ' ' LEU . 1.2 tt -64.28 -46.45 83.64 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.747 -178.751 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 8.7 mm100 -53.86 -35.85 61.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.263 179.428 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.25 -26.91 35.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.469 177.904 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 4.2 t60 . . . . . 0 C--N 1.332 -0.196 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.847 179.724 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B ' 5' ' ' ASN . . . . . 0.639 ' HB3' ' HG2' ' A' ' 71' ' ' GLU . 39.2 m-20 . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.766 0.317 . . . . 0.0 110.874 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.454 ' HB3' HD11 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -74.15 -87.87 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.408 179.349 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' B' B ' 7' ' ' ASN . . . . . 0.727 HD21 ' H ' ' B' ' 9' ' ' ASN . 0.2 OUTLIER -74.41 131.5 80.23 Favored Pre-proline 0 C--N 1.332 -0.176 0 CA-C-N 116.616 -0.265 . . . . 0.0 110.546 178.714 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . 0.519 ' HD2' ' ND2' ' B' ' 7' ' ' ASN . 71.9 Cg_endo -75.24 -3.91 14.59 Favored 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.109 1.872 . . . . 0.0 112.096 179.262 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 9' ' ' ASN . . . . . 0.727 ' H ' HD21 ' B' ' 7' ' ' ASN . 71.8 m-80 -123.35 49.8 1.65 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.657 179.543 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.17 95.0 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.714 -179.283 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.63 ' C ' ' HA ' ' A' ' 46' ' ' MET . 6.0 mttp -109.57 124.26 50.82 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.704 179.288 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . 0.677 ' HG2' ' HE3' ' A' ' 42' ' ' LYS . 51.6 mt-10 -47.48 173.01 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -177.895 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 13' ' ' PHE . . . . . 0.778 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.4 OUTLIER . . . . . 0 N--CA 1.463 0.192 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.352 -179.929 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.907 0.384 . . . . 0.0 110.735 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 1.7 t80 . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.055 -179.35 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.718 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 1.8 t . . . . . 0 N--CA 1.455 -0.187 0 CA-C-O 120.601 0.239 . . . . 0.0 110.469 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.411 ' HB2' ' OE1' ' A' ' 33' ' ' GLN . . . -59.26 -37.06 76.67 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 177.237 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.4 t -69.08 -35.54 76.61 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.659 177.014 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.718 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.2 mtm -64.17 -36.47 84.16 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.886 177.669 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.734 HD12 ' HB3' ' A' ' 24' ' ' LEU . 2.4 mp -52.27 -48.94 65.0 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.156 179.356 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.02 -31.09 71.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.129 178.903 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 56.8 m -101.44 15.47 28.73 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.757 -178.882 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.619 ' HB2' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.031 179.967 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.676 ' HG3' ' HB3' ' A' ' 22' ' ' GLN . 4.6 tp10 . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.691 0.281 . . . . 0.0 111.081 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.432 ' HG3' ' H ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -52.83 -60.08 3.7 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.345 -179.868 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.512 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.86 -20.54 15.91 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.496 -178.171 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.676 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -73.2 -79.98 0.07 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.908 0.385 . . . . 0.0 111.425 179.317 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' MET . . . . . 0.72 ' HE3' ' HA ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.55 -94.39 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.687 -176.979 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.734 ' HB3' HD12 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -62.11 -1.56 0.73 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -175.291 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.574 ' O ' HD23 ' A' ' 24' ' ' LEU . . . 64.87 -116.71 9.27 Favored Glycine 0 N--CA 1.444 -0.794 0 N-CA-C 108.427 -1.869 . . . . 0.0 108.427 -174.268 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.741 ' HG3' HD23 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -76.63 -69.63 0.5 Allowed 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 169.43 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.938 ' HG3' HD22 ' A' ' 31' ' ' LEU . 1.3 tpt180 -159.86 12.46 0.13 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.318 -1.31 . . . . 0.0 107.985 176.09 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.658 ' HA ' HD11 ' A' ' 31' ' ' LEU . 3.6 mm? -57.54 -76.06 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.488 -1.233 . . . . 0.0 113.606 -173.243 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.57 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -41.0 -46.65 6.97 Favored Pre-proline 0 C--N 1.325 -0.495 0 N-CA-C 113.728 1.01 . . . . 0.0 113.728 -174.653 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.582 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 50.4 Cg_exo -57.53 -43.83 47.55 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.236 1.957 . . . . 0.0 113.818 -178.216 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.938 HD22 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.7 -48.83 52.62 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.228 -178.066 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.793 HD11 ' HB ' ' A' ' 43' ' ' ILE . 0.9 OUTLIER -73.43 -14.52 16.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.522 179.15 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.624 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.7 OUTLIER -60.88 -42.33 97.76 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 177.03 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.65 -30.02 70.66 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.143 174.902 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' MET . . . . . 0.568 ' SD ' HG13 ' A' ' 69' ' ' VAL . 6.3 mtt -101.41 26.79 6.84 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.657 178.576 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.624 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.4 p-80 -66.04 -32.37 5.61 Favored Pre-proline 0 CA--C 1.537 0.46 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -177.457 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.593 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 44.0 Cg_exo -34.11 -35.9 0.09 OUTLIER 'Trans proline' 0 C--N 1.363 1.318 0 C-N-CA 122.383 2.055 . . . . 0.0 112.466 179.457 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.8 m -78.76 -84.13 0.08 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.816 176.891 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.763 ' HB3' HD22 ' A' ' 76' ' ' LEU . 0.6 OUTLIER -171.36 63.54 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.396 178.212 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.54 ' HB3' ' HB ' ' A' ' 32' ' ' ILE . . . -50.09 -38.29 37.86 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.888 0.375 . . . . 0.0 111.398 179.516 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.57 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -47.94 -47.94 25.24 Favored Glycine 0 CA--C 1.517 0.197 0 CA-C-N 115.782 -0.645 . . . . 0.0 114.13 -178.227 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.848 ' HG3' ' HE1' ' A' ' 46' ' ' MET . 2.2 tptm -77.74 -42.59 33.66 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -177.192 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.793 ' HB ' HD11 ' A' ' 32' ' ' ILE . 20.3 mt -53.51 -56.51 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 C-N-CA 120.761 -0.376 . . . . 0.0 111.288 -178.267 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.56 HG23 ' CD2' ' A' ' 29' ' ' PHE . 9.8 t -47.04 -46.92 22.49 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 179.234 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.902 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -51.57 -67.51 1.96 Allowed Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 115.33 -0.85 . . . . 0.0 113.212 179.352 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.848 ' HE1' ' HG3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.57 -57.75 10.65 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -177.246 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.667 HD22 ' HB2' ' B' ' 7' ' ' ASN . 3.5 mp -79.39 14.52 1.54 Allowed 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -177.068 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.527 HD11 ' O ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -66.71 -10.51 47.48 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.235 0.54 . . . . 0.0 109.543 176.359 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.498 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 3.5 mt-10 -80.17 19.89 0.7 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.711 178.96 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.443 HG12 ' HG2' ' A' ' 54' ' ' GLU . 1.3 tt -83.31 162.64 3.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.021 -179.236 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.446 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 4.0 m-20 -70.66 156.78 39.03 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.946 0.403 . . . . 0.0 111.72 -178.449 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.729 ' HA ' HD23 ' A' ' 55' ' ' LEU . 6.5 m120 -84.09 -30.11 26.26 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.21 178.312 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 8.4 t -73.9 -34.03 64.25 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.369 0.604 . . . . 0.0 109.53 177.342 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.446 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -75.84 -28.54 58.28 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.52 179.147 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.741 HD23 ' HG3' ' A' ' 26' ' ' GLU . 0.7 OUTLIER -59.59 -46.54 88.63 Favored 'General case' 0 CA--C 1.522 -0.128 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.298 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.722 ' HA ' HD22 ' A' ' 59' ' ' LEU . 61.7 tp -57.83 -49.39 76.83 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.072 -179.678 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.446 ' O ' ' HB2' ' A' ' 61' ' ' SER . 19.3 m-70 -58.78 -21.61 56.33 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.806 -178.992 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.647 ' HE2' ' HZ3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -76.17 -57.99 3.54 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -177.742 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.73 HD23 ' H ' ' A' ' 59' ' ' LEU . 2.2 pt? -65.73 -6.86 12.88 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.538 -0.465 . . . . 0.0 111.098 -178.864 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -105.98 -9.43 17.07 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.94 0.4 . . . . 0.0 110.634 177.745 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.581 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -122.66 97.93 43.82 Favored Pre-proline 0 C--N 1.331 -0.199 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.099 179.61 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -64.94 -30.07 57.55 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.188 1.925 . . . . 0.0 111.924 179.114 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.457 ' O ' ' HB2' ' A' ' 67' ' ' SER . 3.2 mm-40 -78.31 -51.77 9.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.615 -179.75 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.412 ' HB3' ' HB3' ' A' ' 61' ' ' SER . 47.3 t -69.23 -40.29 78.01 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.887 -177.819 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.641 HD11 ' HB3' ' A' ' 31' ' ' LEU . 0.3 OUTLIER -77.95 -65.14 1.01 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.177 -176.179 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.49 ' HA ' ' HE3' ' A' ' 35' ' ' MET . 0.0 OUTLIER -51.06 -33.7 26.83 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.885 -0.326 . . . . 0.0 111.524 -176.797 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.457 ' HB2' ' O ' ' A' ' 63' ' ' GLU . 2.9 m -69.97 -35.84 74.75 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.001 0.429 . . . . 0.0 110.195 178.286 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.647 ' HZ3' ' HE2' ' A' ' 58' ' ' MET . 0.5 OUTLIER -66.33 -52.34 48.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.304 178.717 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.81 ' HA ' ' HB2' ' A' ' 72' ' ' ALA . 55.4 t -70.37 -16.37 19.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.484 179.127 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.581 ' O ' HG21 ' A' ' 73' ' ' VAL . 20.1 t0 -58.56 -49.05 78.84 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 176.554 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.532 ' O ' ' HB2' ' A' ' 74' ' ' ALA . 2.4 tp10 -68.7 -21.86 64.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.59 176.258 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.81 ' HB2' ' HA ' ' A' ' 69' ' ' VAL . . . -64.18 -45.38 88.66 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.633 179.353 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.581 HG21 ' O ' ' A' ' 70' ' ' ASP . 2.2 m -59.66 -29.77 43.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 176.852 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.532 ' HB2' ' O ' ' A' ' 71' ' ' GLU . . . -67.76 -25.18 65.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.91 178.398 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.569 HG21 ' N ' ' A' ' 76' ' ' LEU . 1.3 m -69.89 -32.72 52.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 178.723 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.763 HD22 ' HB3' ' A' ' 39' ' ' LEU . 8.0 mt -70.98 -57.67 4.32 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.956 179.09 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.518 ' HG3' ' O ' ' A' ' 74' ' ' ALA . 0.0 OUTLIER -51.27 -35.58 38.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.047 179.976 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.16 -26.49 36.01 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.791 177.775 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 23.4 t-80 . . . . . 0 C--N 1.333 -0.118 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.847 179.94 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 5.5 m120 . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.798 0.332 . . . . 0.0 110.943 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.23 -79.16 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.943 179.829 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 7' ' ' ASN . . . . . 0.667 ' HB2' HD22 ' A' ' 47' ' ' LEU . 2.2 t30 -84.16 127.05 68.21 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.051 -179.841 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -78.65 5.03 5.88 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.236 1.957 . . . . 0.0 111.899 178.593 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -123.54 43.02 3.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.917 179.945 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.78 85.26 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.702 -179.768 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.603 ' C ' ' HA ' ' A' ' 46' ' ' MET . 0.4 OUTLIER -117.61 128.13 54.63 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.051 178.537 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . 0.625 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 6.2 tt0 -46.56 167.47 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -175.846 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 13' ' ' PHE . . . . . 0.902 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.4 OUTLIER . . . . . 0 N--CA 1.463 0.208 0 CA-C-N 115.206 -0.906 . . . . 0.0 109.91 179.605 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.956 0.408 . . . . 0.0 110.724 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . 0.461 ' HD2' ' HB3' ' A' ' 48' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.974 -179.351 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.78 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 8.9 t . . . . . 0 N--CA 1.455 -0.222 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.46 -39.47 83.76 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 176.41 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 7.3 t -67.97 -34.62 76.89 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.734 177.111 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.78 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 9.2 mtm -64.43 -39.18 93.35 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.224 178.07 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.678 HD21 ' HB3' ' A' ' 24' ' ' LEU . 38.5 mt -52.27 -45.91 65.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.406 -179.9 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.15 -33.66 76.28 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.02 178.439 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.9 m -101.52 19.95 16.97 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.559 -179.098 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.449 ' HB2' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.331 -0.237 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.096 -179.97 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.458 ' O ' ' HB3' ' A' ' 22' ' ' GLN . 0.3 OUTLIER . . . . . 0 CA--C 1.526 0.046 0 CA-C-O 120.759 0.314 . . . . 0.0 111.158 . . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.523 HE21 ' HB2' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -46.74 -68.77 0.16 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.351 179.853 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.552 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.54 -20.23 12.5 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.775 -177.195 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.552 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 14.9 tt0 -73.35 -80.05 0.07 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.963 0.411 . . . . 0.0 111.533 179.153 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' MET . . . . . 0.431 ' H ' ' HG3' ' A' ' 23' ' ' MET . 0.0 OUTLIER -69.85 -94.14 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 -176.775 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.741 ' HG ' ' HA ' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -61.63 1.6 0.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -174.98 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.479 ' O ' HD21 ' A' ' 24' ' ' LEU . . . 65.1 -117.52 10.47 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 108.598 -1.801 . . . . 0.0 108.598 -174.856 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.5 ' N ' HD22 ' A' ' 48' ' ' LEU . 0.2 OUTLIER -75.42 -67.25 0.68 Allowed 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 168.985 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.857 ' HG2' HD12 ' A' ' 59' ' ' LEU . 8.7 tpt180 -160.3 6.04 0.08 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.188 -1.369 . . . . 0.0 107.862 174.859 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.712 ' HA ' HD12 ' A' ' 31' ' ' LEU . 0.4 OUTLIER -60.01 -75.29 0.06 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.235 -1.348 . . . . 0.0 114.582 -172.175 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.486 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.2 OUTLIER -32.86 -50.81 0.63 Allowed Pre-proline 0 N--CA 1.468 0.468 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -175.484 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.606 ' HG2' ' O ' ' A' ' 27' ' ' ARG . 16.9 Cg_endo -60.25 -40.27 60.72 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 122.132 1.888 . . . . 0.0 113.167 -178.413 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.853 HD23 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.16 -48.42 51.97 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.136 179.844 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.611 HG12 HG12 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -68.47 -20.61 25.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.229 -0.442 . . . . 0.0 109.892 178.045 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.657 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -63.44 -32.31 73.72 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 176.839 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.71 -26.04 63.22 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 174.903 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' MET . . . . . 0.44 ' SD ' HG11 ' A' ' 69' ' ' VAL . 10.2 mtt -102.03 14.07 32.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.559 -1.2 . . . . 0.0 109.749 177.471 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.786 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 0.0 OUTLIER -62.51 -36.39 26.91 Favored Pre-proline 0 CA--C 1.533 0.293 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.946 -179.388 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.786 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 1.3 Cg_endo -42.5 -26.98 0.67 Allowed 'Trans proline' 0 C--N 1.362 1.246 0 C-N-CA 121.969 1.779 . . . . 0.0 110.691 177.435 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.48 ' O ' HD22 ' A' ' 39' ' ' LEU . 0.9 OUTLIER -81.93 -82.12 0.14 Allowed 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.37 175.376 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.48 HD22 ' O ' ' A' ' 38' ' ' THR . 0.2 OUTLIER -172.19 65.69 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 178.347 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.444 ' HA ' HD13 ' A' ' 43' ' ' ILE . . . -64.15 -172.52 0.07 Allowed 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 176.098 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.511 ' O ' HG21 ' A' ' 44' ' ' THR . . . 108.38 -106.75 2.38 Favored Glycine 0 C--O 1.227 -0.335 0 C-N-CA 120.172 -1.014 . . . . 0.0 113.056 179.476 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.478 ' HA ' ' HD3' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -56.8 -22.51 36.72 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.659 0.266 . . . . 0.0 111.622 -178.077 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.64 HG12 ' HB2' ' A' ' 76' ' ' LEU . 40.7 mt -54.09 -46.2 66.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.76 0.314 . . . . 0.0 110.934 179.684 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.633 ' HA ' ' CD2' ' A' ' 28' ' ' LEU . 15.4 t -57.14 -44.81 83.74 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.264 -179.606 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -49.36 -43.53 34.79 Favored Glycine 0 CA--C 1.519 0.288 0 C-N-CA 121.2 -0.524 . . . . 0.0 113.766 -178.305 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.659 ' HE3' HG23 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -76.1 -51.9 11.27 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -177.54 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.655 ' HB2' HD22 ' A' ' 28' ' ' LEU . 2.8 mm? -79.67 -0.05 32.35 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.985 -178.693 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.563 ' C ' ' H ' ' A' ' 50' ' ' ILE . 0.2 OUTLIER -66.19 -15.68 63.35 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 121.381 0.61 . . . . 0.0 109.938 177.66 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.493 ' N ' ' OE1' ' A' ' 49' ' ' GLU . 0.6 OUTLIER -74.6 17.08 0.22 Allowed 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.572 179.233 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.563 ' H ' ' C ' ' A' ' 48' ' ' LEU . 1.2 tt -84.59 170.35 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.75 179.368 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.613 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 6.9 m-20 -71.56 147.18 47.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.913 0.387 . . . . 0.0 111.721 179.993 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.522 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 2.1 t-20 -78.56 -30.84 47.04 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 176.771 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.568 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 0.6 OUTLIER -74.14 -30.46 62.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.395 0.617 . . . . 0.0 109.825 177.234 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.613 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -79.22 -22.67 44.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.364 179.068 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.773 HD12 ' HB2' ' A' ' 27' ' ' ARG . 0.6 OUTLIER -63.53 -47.82 80.07 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.392 179.258 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 53' ' ' SER . 2.3 pp -61.29 -41.45 96.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.907 0.384 . . . . 0.0 110.266 179.455 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.0 -13.09 56.96 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.947 178.78 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.615 ' HE2' ' NZ ' ' A' ' 68' ' ' LYS . 22.4 mmt -76.45 -57.38 3.9 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.473 -179.494 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.857 HD12 ' HG2' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -64.3 -10.79 26.33 Favored 'General case' 0 N--CA 1.463 0.176 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.206 179.286 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.488 ' N ' HD22 ' A' ' 59' ' ' LEU . 2.6 tp10 -92.44 -19.12 22.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.276 178.186 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.624 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 1.3 t -122.78 88.48 50.22 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.917 179.369 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -62.5 -31.27 80.42 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.281 1.987 . . . . 0.0 112.202 179.803 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -77.8 -48.44 16.56 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.424 -179.653 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.434 ' O ' ' HB2' ' A' ' 67' ' ' SER . 16.9 m -68.95 -47.73 64.94 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.027 0.442 . . . . 0.0 111.093 -178.935 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.699 HD21 HD22 ' A' ' 31' ' ' LEU . 0.6 OUTLIER -57.93 -64.17 1.0 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.749 -0.66 . . . . 0.0 112.01 -178.575 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.619 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.9 OUTLIER -49.03 -32.24 9.03 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.233 -177.084 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.489 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 5.1 m -58.71 -45.27 89.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.163 0.506 . . . . 0.0 110.196 178.233 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.615 ' NZ ' ' HE2' ' A' ' 58' ' ' MET . 12.3 mtmm -65.48 -64.47 0.85 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.716 179.472 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.803 ' HA ' ' HB2' ' A' ' 72' ' ' ALA . 82.8 t -57.52 -20.16 13.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.358 -178.8 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.489 ' HB3' ' O ' ' A' ' 67' ' ' SER . 5.9 t70 -55.92 -51.3 68.11 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 176.468 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.95 -29.17 67.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.827 177.049 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.803 ' HB2' ' HA ' ' A' ' 69' ' ' VAL . . . -58.61 -40.98 84.81 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.32 178.543 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.609 ' HA ' HD11 ' A' ' 43' ' ' ILE . 24.8 t -62.24 -32.22 54.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 177.061 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.52 -38.63 74.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.289 179.394 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.718 HG13 ' HA ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.9 -27.96 36.86 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 CA-C-O 120.995 0.426 . . . . 0.0 110.337 179.556 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.64 ' HB2' HG12 ' A' ' 43' ' ' ILE . 2.8 tm? -71.07 -48.76 50.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.317 178.865 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -60.1 -33.24 71.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.711 179.914 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.89 -20.08 42.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.871 179.138 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 . . . . . 0 C--N 1.331 -0.236 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.879 -179.93 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.167 0 CA-C-O 120.833 0.349 . . . . 0.0 110.923 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 35.7 mt -75.98 -79.28 0.1 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.933 -179.97 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 7' ' ' ASN . . . . . 0.615 HD21 ' H ' ' B' ' 9' ' ' ASN . 0.5 OUTLIER -79.49 127.76 77.33 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.273 -179.36 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -79.76 0.43 10.03 Favored 'Trans proline' 0 N--CA 1.459 -0.508 0 C-N-CA 122.744 2.296 . . . . 0.0 112.072 179.502 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 9' ' ' ASN . . . . . 0.615 ' H ' HD21 ' B' ' 7' ' ' ASN . 44.0 m-20 -123.51 48.82 1.79 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.877 179.845 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . 0.441 ' CA ' ' HB3' ' A' ' 46' ' ' MET . . . -60.89 99.13 0.08 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.081 -0.508 . . . . 0.0 112.068 -179.697 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.539 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.1 OUTLIER -128.0 -178.37 4.49 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 120.776 0.322 . . . . 0.0 110.987 177.432 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -68.61 176.98 2.65 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 121.001 0.429 . . . . 0.0 111.459 -179.55 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 13' ' ' PHE . . . . . 0.479 ' CZ ' HD12 ' A' ' 48' ' ' LEU . 1.0 OUTLIER . . . . . 0 C--N 1.333 -0.134 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.13 178.053 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.442 ' HG3' HE22 ' A' ' 20' ' ' GLN . 3.9 mtpp . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.571 0.224 . . . . 0.0 110.464 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . 0.432 ' OH ' ' HG3' ' B' ' 11' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.328 0 CA-C-O 120.831 0.348 . . . . 0.0 110.738 -179.837 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.808 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 13.1 t . . . . . 0 N--CA 1.455 -0.197 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.45 -35.66 74.48 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 176.869 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 26.8 t -72.96 -34.83 66.74 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.849 177.572 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.808 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 4.8 mtm -64.33 -38.72 92.04 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.013 178.189 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.673 HD23 ' HB3' ' A' ' 24' ' ' LEU . 37.3 mt -52.61 -51.29 60.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.099 179.37 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.25 -28.14 68.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.827 177.953 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.66 20.46 16.15 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.77 -178.702 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.543 ' HB3' ' HE1' ' A' ' 23' ' ' MET . . . . . . . . 0 C--N 1.329 -0.307 0 CA-C-O 120.612 0.244 . . . . 0.0 111.12 -179.924 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.427 ' OE2' ' HG2' ' A' ' 22' ' ' GLN . 0.4 OUTLIER . . . . . 0 N--CA 1.453 -0.313 0 CA-C-O 120.603 0.24 . . . . 0.0 110.871 . . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -46.05 -65.73 0.51 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.375 -178.651 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.482 ' H ' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -55.76 -24.88 37.92 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.265 -178.79 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.427 ' HG2' ' OE2' ' A' ' 19' ' ' GLU . 6.6 tp60 -73.62 -77.36 0.11 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.736 0.303 . . . . 0.0 111.648 179.164 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' MET . . . . . 0.676 ' HA ' ' HE2' ' A' ' 11' ' ' MET . 0.0 OUTLIER -67.24 -97.06 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 112.543 0.571 . . . . 0.0 112.543 -176.375 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.673 ' HB3' HD23 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -62.09 1.07 0.33 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 113.604 0.965 . . . . 0.0 113.604 -175.525 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.549 ' HA3' HD22 ' A' ' 48' ' ' LEU . . . 64.71 -118.47 12.55 Favored Glycine 0 N--CA 1.445 -0.757 0 N-CA-C 108.435 -1.866 . . . . 0.0 108.435 -174.865 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 51' ' ' ASP . 1.8 mp0 -75.78 -68.45 0.57 Allowed 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 168.831 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.777 ' HB2' HD12 ' A' ' 55' ' ' LEU . 8.4 tpt85 -160.24 13.26 0.12 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 113.986 -1.461 . . . . 0.0 107.814 174.59 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.668 HD11 ' HA ' ' A' ' 44' ' ' THR . 1.4 mm? -56.98 -80.23 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 114.568 -1.196 . . . . 0.0 113.627 -173.125 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.578 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -36.14 -49.78 1.67 Allowed Pre-proline 0 CA--C 1.537 0.447 0 N-CA-C 113.626 0.972 . . . . 0.0 113.626 -174.501 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.734 ' HB2' ' NH1' ' A' ' 27' ' ' ARG . 50.6 Cg_exo -58.03 -40.92 73.4 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.209 1.939 . . . . 0.0 113.938 -177.852 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.692 HD23 ' NH1' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.86 -47.24 60.37 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 120.343 -0.543 . . . . 0.0 109.906 -179.195 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.766 HG12 HG13 ' A' ' 69' ' ' VAL . 0.3 OUTLIER -74.14 -13.52 15.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.049 178.5 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.627 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 1.5 tt0 -61.46 -42.01 98.1 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 108.55 -0.908 . . . . 0.0 108.55 177.357 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.93 -30.2 70.27 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.077 174.958 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' MET . . . . . 0.611 ' HE3' ' HA ' ' A' ' 66' ' ' ARG . 6.7 mtt -100.25 26.11 6.88 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.52 178.364 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.627 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.6 p-80 -63.81 -32.82 8.49 Favored Pre-proline 0 CA--C 1.537 0.445 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -177.726 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.592 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 49.2 Cg_exo -34.56 -35.49 0.1 OUTLIER 'Trans proline' 0 C--N 1.363 1.324 0 C-N-CA 122.316 2.011 . . . . 0.0 112.258 178.897 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.2 m -77.9 -86.11 0.06 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.631 176.547 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.733 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -171.58 65.22 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.302 178.003 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.617 ' HB2' ' HB ' ' A' ' 32' ' ' ILE . . . -49.78 -33.67 17.1 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.452 179.655 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.578 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -50.5 -56.3 13.7 Favored Glycine 0 C--N 1.33 0.201 0 CA-C-N 115.973 -0.558 . . . . 0.0 114.046 -178.294 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.561 ' HE2' ' SD ' ' A' ' 46' ' ' MET . 2.0 tptm -77.54 -38.75 48.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 117.128 0.464 . . . . 0.0 111.952 -177.637 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.711 HD12 ' HA ' ' A' ' 73' ' ' VAL . 18.3 mt -54.33 -56.21 11.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 121.203 -0.199 . . . . 0.0 111.399 -178.698 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.668 ' HA ' HD11 ' A' ' 28' ' ' LEU . 5.8 t -47.69 -47.7 29.57 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 178.552 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.657 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -49.41 -65.48 2.75 Favored Glycine 0 N--CA 1.451 -0.331 0 CA-C-N 115.656 -0.702 . . . . 0.0 113.621 -179.826 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.599 ' HE1' HG21 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -54.48 -71.23 0.08 Allowed 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 -176.599 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.702 HD21 ' HB2' ' B' ' 7' ' ' ASN . 3.7 mp -66.87 6.17 0.54 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -176.621 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.61 ' HB2' ' O ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -66.84 -1.57 4.1 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.051 0.453 . . . . 0.0 110.539 177.125 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.594 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 1.2 mm-40 -81.99 19.08 1.19 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.579 176.716 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.616 HD12 ' HE3' ' A' ' 68' ' ' LYS . 2.0 tt -82.28 165.1 2.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.175 -178.412 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.431 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 34.5 m-20 -70.42 160.95 31.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.731 -178.751 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.508 ' HA ' HD22 ' A' ' 55' ' ' LEU . 5.1 m120 -87.22 -30.29 21.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.872 177.375 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.6 t -73.86 -29.03 61.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.791 177.714 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.425 ' HG3' ' HB2' ' A' ' 51' ' ' ASP . 4.3 mt-10 -79.65 -29.26 40.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.555 178.804 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.777 HD12 ' HB2' ' A' ' 27' ' ' ARG . 0.5 OUTLIER -58.88 -46.49 87.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.976 0.417 . . . . 0.0 110.07 179.395 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.463 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 1.9 tm? -62.62 -41.76 99.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.192 178.623 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.496 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 0.9 OUTLIER -60.88 -34.98 75.45 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.537 178.897 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.547 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -68.91 -43.49 75.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.171 178.758 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.491 ' HB2' ' HG2' ' A' ' 27' ' ' ARG . 5.4 tp -69.79 -15.1 63.06 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.663 179.49 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.496 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 4.6 pt-20 -102.53 -7.92 21.47 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.009 179.456 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.563 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -125.58 89.02 53.26 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.99 179.65 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -61.69 -32.92 86.94 Favored 'Trans proline' 0 C--N 1.343 0.261 0 C-N-CA 122.266 1.977 . . . . 0.0 111.997 179.538 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -78.05 -48.4 16.19 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.489 -179.683 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.419 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 15.5 m -69.37 -52.18 29.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.956 0.408 . . . . 0.0 111.397 -178.641 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.676 HD12 ' HB3' ' A' ' 31' ' ' LEU . 0.1 OUTLIER -58.1 -57.81 11.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.316 -178.53 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.611 ' HA ' ' HE3' ' A' ' 35' ' ' MET . 0.5 OUTLIER -51.8 -33.81 37.3 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.492 -178.936 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.574 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 3.9 m -69.71 -35.96 75.5 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.142 0.496 . . . . 0.0 110.094 177.818 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.616 ' HE3' HD12 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -66.09 -56.78 9.79 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.992 178.233 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.776 ' HA ' ' HB2' ' A' ' 72' ' ' ALA . 49.1 t -67.7 -15.18 19.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.489 178.585 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.641 ' O ' HG22 ' A' ' 73' ' ' VAL . 10.7 t70 -57.62 -49.42 76.49 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 176.362 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.421 ' O ' HG13 ' A' ' 75' ' ' VAL . 22.0 tt0 -68.34 -26.49 65.62 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.44 176.476 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.776 ' HB2' ' HA ' ' A' ' 69' ' ' VAL . . . -62.43 -43.64 98.33 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.183 179.699 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.711 ' HA ' HD12 ' A' ' 43' ' ' ILE . 2.8 m -62.7 -30.58 49.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.941 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.99 -36.57 77.98 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.037 178.872 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.702 HG12 ' HA ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -60.21 -32.31 50.32 Favored 'Isoleucine or valine' 0 C--O 1.231 0.121 0 CA-C-O 121.025 0.441 . . . . 0.0 110.175 179.218 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.733 ' HG ' ' HB3' ' A' ' 39' ' ' LEU . 2.6 tm? -71.75 -47.93 50.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.203 178.51 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -55.79 -36.99 68.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.51 179.343 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.49 -15.62 54.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.205 179.527 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.265 0 CA-C-O 120.804 0.335 . . . . 0.0 111.024 -179.618 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 3.6 m120 . . . . . 0 C--O 1.23 0.059 0 CA-C-O 120.814 0.34 . . . . 0.0 111.044 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.458 HD22 ' O ' ' A' ' 68' ' ' LYS . 41.7 tp -76.41 -76.31 0.17 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.812 179.995 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 7' ' ' ASN . . . . . 0.702 ' HB2' HD21 ' A' ' 47' ' ' LEU . 2.1 t30 -83.4 122.27 77.03 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.74 179.341 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 5.2 Cg_exo -77.61 7.37 3.89 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 122.543 2.162 . . . . 0.0 111.858 179.381 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 9' ' ' ASN . . . . . 0.412 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 4.0 m120 -123.15 38.39 4.2 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.08 -179.593 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.57 89.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.852 -179.266 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.594 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 1.1 mmtp -125.71 129.96 50.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.828 177.952 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . 0.529 ' HG2' ' HZ1' ' A' ' 42' ' ' LYS . 6.6 mt-10 -46.63 170.72 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -176.282 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 13' ' ' PHE . . . . . 0.657 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.4 OUTLIER . . . . . 0 CA--C 1.519 -0.218 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.163 178.946 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.893 0.378 . . . . 0.0 110.839 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.996 -179.696 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.752 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 15.1 t . . . . . 0 CA--C 1.522 -0.107 0 N-CA-C 110.257 -0.275 . . . . 0.0 110.257 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.5 -36.25 75.69 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 176.566 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 16.8 t -67.77 -34.83 77.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.668 177.399 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.752 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 9.6 mtm -64.26 -37.34 87.12 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.006 177.696 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.765 HD11 ' HB3' ' A' ' 24' ' ' LEU . 2.0 mp -51.9 -47.67 64.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.096 179.364 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.26 -34.33 77.76 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.23 178.644 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.2 m -100.36 21.95 12.34 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.631 -178.63 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.512 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.012 179.568 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.512 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 1.2 tp10 . . . . . 0 CA--C 1.527 0.067 0 CA-C-O 120.667 0.27 . . . . 0.0 111.287 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.42 HE21 ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -51.02 -59.84 3.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.299 -179.92 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.42 ' HG3' HE21 ' A' ' 20' ' ' GLN . 0.0 OUTLIER -55.65 -21.47 18.16 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.514 -178.122 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.467 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 5.4 tt0 -73.2 -79.24 0.08 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.989 0.423 . . . . 0.0 111.512 179.206 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' MET . . . . . 0.738 ' HE3' ' HA ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.32 -94.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.795 -0.638 . . . . 0.0 112.685 -176.935 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.765 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -62.02 -0.81 0.55 Allowed 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.434 0.902 . . . . 0.0 113.434 -175.363 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.577 ' O ' HD21 ' A' ' 24' ' ' LEU . . . 64.86 -117.18 9.96 Favored Glycine 0 N--CA 1.444 -0.815 0 N-CA-C 108.474 -1.85 . . . . 0.0 108.474 -174.853 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.654 ' HG3' HD21 ' A' ' 55' ' ' LEU . 0.7 OUTLIER -76.08 -68.73 0.55 Allowed 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 169.247 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.862 ' HB2' HD12 ' A' ' 55' ' ' LEU . 7.8 tpt180 -160.07 12.84 0.12 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 114.47 -1.241 . . . . 0.0 108.424 175.673 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.496 ' O ' HG13 ' A' ' 32' ' ' ILE . 4.0 mm? -57.02 -78.89 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.622 -1.172 . . . . 0.0 113.623 -173.043 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.595 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -36.6 -48.92 1.85 Allowed Pre-proline 0 CA--C 1.537 0.452 0 N-CA-C 113.48 0.919 . . . . 0.0 113.48 -175.062 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.566 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 52.4 Cg_exo -56.62 -43.42 55.26 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.293 1.995 . . . . 0.0 113.719 -178.279 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.61 -46.08 64.06 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.169 0.509 . . . . 0.0 110.124 -178.242 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.714 HD12 ' HB ' ' A' ' 43' ' ' ILE . 0.3 OUTLIER -77.72 -12.38 13.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.453 179.105 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.619 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 11.2 tp60 -62.65 -38.67 91.19 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 176.654 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.73 -31.51 70.64 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.053 -0.976 . . . . 0.0 108.967 174.482 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' MET . . . . . 0.641 ' SD ' HG13 ' A' ' 69' ' ' VAL . 7.6 mtt -100.27 27.43 5.68 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.35 178.023 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.807 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 1.7 p-80 -63.63 -32.88 8.78 Favored Pre-proline 0 CA--C 1.536 0.423 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -177.869 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.807 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 3.4 Cg_exo -35.3 -32.82 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.284 0 C-N-CA 122.687 2.258 . . . . 0.0 112.211 179.488 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.402 ' N ' ' O ' ' A' ' 36' ' ' HIS . 45.4 m -78.09 -86.83 0.06 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.101 -0.499 . . . . 0.0 109.811 176.637 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.658 ' O ' HG13 ' A' ' 43' ' ' ILE . 6.1 tp -171.47 56.08 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.512 178.175 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.6 ' HB2' ' HB ' ' A' ' 32' ' ' ILE . . . -39.87 -34.7 0.29 Allowed 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -179.865 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.595 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.58 -58.96 6.96 Favored Glycine 0 CA--C 1.519 0.289 0 CA-C-N 116.058 -0.519 . . . . 0.0 114.021 -179.049 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.74 ' HB3' HD13 ' A' ' 76' ' ' LEU . 0.3 OUTLIER -77.48 -30.35 53.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 117.068 0.434 . . . . 0.0 111.574 -178.356 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.717 HG12 HD23 ' A' ' 76' ' ' LEU . 5.1 mt -57.19 -58.21 6.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.116 -179.271 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.584 HG23 ' CD2' ' A' ' 29' ' ' PHE . 5.3 t -47.72 -45.89 29.23 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.984 0.421 . . . . 0.0 110.526 178.661 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.734 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -50.86 -66.94 2.16 Favored Glycine 0 N--CA 1.452 -0.279 0 CA-C-N 115.511 -0.768 . . . . 0.0 113.709 -179.28 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.642 ' SD ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.37 -49.99 70.86 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 117.047 0.423 . . . . 0.0 111.527 -177.744 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.534 ' N ' HD21 ' A' ' 47' ' ' LEU . 2.9 mm? -76.49 3.33 11.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.542 -178.389 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.53 ' O ' HD12 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -66.29 -10.29 41.08 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.991 0.424 . . . . 0.0 110.55 179.545 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' B' ' 9' ' ' ASN . 3.1 mm-40 -82.39 19.71 1.19 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.508 178.438 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.543 HD11 ' NZ ' ' A' ' 68' ' ' LYS . 1.1 tt -83.57 164.32 2.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.024 -179.409 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -70.97 157.95 37.33 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.498 -179.404 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.475 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 4.4 m120 -86.1 -29.81 23.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.148 178.14 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -73.32 -33.77 65.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.232 0.539 . . . . 0.0 109.579 177.706 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.425 ' O ' ' SD ' ' A' ' 58' ' ' MET . 3.4 mt-10 -75.73 -29.25 58.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.688 178.945 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.862 HD12 ' HB2' ' A' ' 27' ' ' ARG . 0.7 OUTLIER -58.46 -46.8 85.85 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.877 0.37 . . . . 0.0 110.213 -179.922 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.684 ' HA ' HD11 ' A' ' 59' ' ' LEU . 1.6 tt -59.5 -46.01 90.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.759 179.342 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.574 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 1.5 m80 -62.12 -16.91 55.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.548 -179.519 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.784 ' HE3' ' HD3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -75.88 -56.53 4.59 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 -178.462 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.729 ' H ' HD12 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -64.38 -12.0 38.38 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.269 -0.573 . . . . 0.0 110.678 179.953 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.574 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 2.4 pt-20 -98.7 -12.29 21.15 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.899 179.283 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.529 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.3 OUTLIER -122.96 92.04 49.42 Favored Pre-proline 0 C--N 1.332 -0.186 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.079 179.886 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.411 ' O ' ' HB2' ' A' ' 66' ' ' ARG . 36.0 Cg_endo -64.49 -31.29 61.24 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.337 2.025 . . . . 0.0 112.009 179.409 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.623 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.63 -47.14 17.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.267 179.895 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.623 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 15.1 m -70.95 -55.55 8.12 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.503 -178.564 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.733 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 0.2 OUTLIER -58.19 -61.52 2.5 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.613 -178.184 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.524 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -50.26 -31.21 13.55 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.94 -178.043 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.504 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.6 OUTLIER -68.17 -40.76 82.2 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.1 0.476 . . . . 0.0 110.294 177.949 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.784 ' HD3' ' HE3' ' A' ' 58' ' ' MET . 30.0 mtpt -65.86 -59.38 3.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.566 179.299 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.711 HG11 HG12 ' A' ' 32' ' ' ILE . 44.8 t -60.53 -20.99 22.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.486 179.86 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.574 ' O ' HG22 ' A' ' 73' ' ' VAL . 28.3 t0 -55.61 -48.87 74.18 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.219 -0.659 . . . . 0.0 109.219 176.55 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.498 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 1.1 tt0 -68.98 -26.69 65.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.936 176.845 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.634 ' HB1' ' HA ' ' A' ' 69' ' ' VAL . . . -62.35 -53.36 56.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.022 179.871 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.643 ' HA ' HD11 ' A' ' 43' ' ' ILE . 2.8 m -54.23 -29.4 19.34 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 177.356 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.498 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -70.78 -36.43 73.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.466 179.856 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.558 HG21 HD21 ' A' ' 76' ' ' LEU . 1.5 m -56.23 -28.37 25.6 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 178.673 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.74 HD13 ' HB3' ' A' ' 42' ' ' LYS . 1.6 mm? -71.83 -51.63 21.5 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.126 176.846 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -52.81 -35.16 56.55 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.854 178.507 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -82.29 -21.46 36.15 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.185 178.173 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 9.4 t-80 . . . . . 0 N--CA 1.462 0.157 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.886 -179.373 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.456 -0.147 0 CA-C-O 120.784 0.326 . . . . 0.0 110.46 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.4 tp -75.23 -81.59 0.07 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.782 179.272 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 7' ' ' ASN . . . . . 0.471 HD21 ' H ' ' B' ' 9' ' ' ASN . 0.6 OUTLIER -79.83 120.16 79.08 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.193 179.883 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -76.01 3.09 6.42 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.196 1.93 . . . . 0.0 111.67 178.415 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 9' ' ' ASN . . . . . 0.511 ' HB3' ' NZ ' ' B' ' 11' ' ' LYS . 5.4 m120 -123.3 48.09 1.89 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.477 179.354 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . 0.536 ' HB2' ' HB3' ' A' ' 46' ' ' MET . . . -59.44 96.83 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.801 -179.087 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.511 ' NZ ' ' HB3' ' B' ' 9' ' ' ASN . 8.3 mttp -125.19 133.78 52.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.076 178.189 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . 0.61 ' HG2' ' HE3' ' A' ' 42' ' ' LYS . 44.9 mt-10 -48.29 165.43 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.033 0.444 . . . . 0.0 111.982 -178.591 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 13' ' ' PHE . . . . . 0.734 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.8 OUTLIER . . . . . 0 C--N 1.33 -0.246 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.435 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.891 0.377 . . . . 0.0 110.998 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . 0.401 ' HD1' ' HA ' ' B' ' 19' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.823 -179.771 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.746 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 7.2 t . . . . . 0 N--CA 1.456 -0.126 0 CA-C-O 120.64 0.257 . . . . 0.0 110.484 . . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.433 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.5 -36.89 76.92 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 176.948 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.0 t -68.93 -35.5 76.87 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.599 177.318 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.746 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.3 mtm -64.42 -36.05 82.9 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.972 177.506 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.711 ' HA ' ' HE3' ' A' ' 23' ' ' MET . 3.1 mp -52.15 -48.18 65.03 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.113 179.185 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.02 -33.86 76.78 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.15 178.846 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.7 m -101.5 25.53 8.3 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.715 -178.811 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.47 ' HB3' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.271 179.556 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.511 ' HG3' ' HB3' ' A' ' 22' ' ' GLN . 1.4 tp10 . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.653 0.263 . . . . 0.0 111.043 . . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.546 HE21 ' HB2' ' A' ' 21' ' ' LYS . 0.2 OUTLIER -59.23 -49.27 78.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.011 0.434 . . . . 0.0 110.764 -179.723 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.546 ' HB2' HE21 ' A' ' 20' ' ' GLN . 0.3 OUTLIER -56.82 -22.46 36.63 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.159 -179.303 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.511 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 4.1 tt0 -72.96 -76.5 0.12 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.946 0.403 . . . . 0.0 111.413 179.728 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' MET . . . . . 0.711 ' HE3' ' HA ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.73 -95.76 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -176.854 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.547 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -62.14 1.64 0.29 Allowed 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -175.602 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.55 -116.49 9.09 Favored Glycine 0 N--CA 1.444 -0.816 0 N-CA-C 108.226 -1.95 . . . . 0.0 108.226 -174.376 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.562 ' HB3' ' HB2' ' A' ' 55' ' ' LEU . 1.9 mp0 -75.75 -69.18 0.51 Allowed 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 168.814 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.844 ' HG3' HD21 ' A' ' 31' ' ' LEU . 23.3 tpt180 -160.25 8.9 0.1 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.132 -1.394 . . . . 0.0 107.458 175.416 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.57 HD22 ' HB2' ' A' ' 47' ' ' LEU . 0.2 OUTLIER -58.28 -74.82 0.06 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.398 -1.274 . . . . 0.0 113.879 -172.259 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.618 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -38.54 -47.0 3.18 Favored Pre-proline 0 CA--C 1.536 0.441 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 -175.229 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.488 ' HD2' ' O ' ' A' ' 27' ' ' ARG . 52.2 Cg_exo -57.5 -42.04 65.41 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.172 1.915 . . . . 0.0 113.398 -179.126 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.844 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.79 -43.26 69.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.18 0.514 . . . . 0.0 109.833 -179.067 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.722 HG12 HG12 ' A' ' 69' ' ' VAL . 0.4 OUTLIER -77.01 -15.57 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.06 177.901 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.645 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 4.9 tt0 -63.17 -35.08 79.11 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 177.101 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.26 -30.19 65.99 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.011 -0.995 . . . . 0.0 108.651 174.676 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' MET . . . . . 0.657 ' SD ' HG11 ' A' ' 69' ' ' VAL . 7.7 mtt -100.12 24.66 8.35 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.881 177.539 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.645 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -64.65 -31.46 5.68 Favored Pre-proline 0 CA--C 1.535 0.377 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.694 -178.213 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.555 ' CD ' ' N ' ' A' ' 36' ' ' HIS . 64.5 Cg_exo -38.61 -27.65 0.12 Allowed 'Trans proline' 0 C--N 1.363 1.313 0 C-N-CA 121.98 1.786 . . . . 0.0 111.9 178.244 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.825 HG22 HD13 ' A' ' 39' ' ' LEU . 13.6 m -77.66 -95.32 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 175.8 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.825 HD13 HG22 ' A' ' 38' ' ' THR . 2.2 mp -154.59 42.34 0.49 Allowed 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 177.662 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.531 ' HB1' ' HA ' ' A' ' 36' ' ' HIS . . . -42.19 105.99 0.05 Allowed 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 178.065 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.618 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . 170.49 -63.75 0.17 Allowed Glycine 0 N--CA 1.447 -0.576 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.883 -176.846 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.676 ' HE3' ' HG2' ' B' ' 12' ' ' GLU . 0.0 OUTLIER -77.86 -30.6 50.99 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.745 0.307 . . . . 0.0 110.658 178.773 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.769 HD13 ' HA ' ' A' ' 73' ' ' VAL . 60.0 mt -54.05 -62.22 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.244 -179.711 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.539 ' HA ' ' CD2' ' A' ' 28' ' ' LEU . 9.9 t -47.1 -41.14 16.69 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.185 -179.471 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.685 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -53.3 -63.71 4.83 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.854 178.769 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.67 ' HE3' HG21 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -55.63 -51.06 68.47 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.686 0.279 . . . . 0.0 111.476 -178.548 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.574 HD22 ' O ' ' A' ' 43' ' ' ILE . 2.3 mm? -78.67 4.8 12.64 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.772 -178.044 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.682 ' HB3' ' HD2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -66.25 -11.74 52.08 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.919 0.39 . . . . 0.0 110.62 179.371 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.428 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 3.2 mm-40 -74.64 13.5 0.61 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.265 177.605 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.56 HG21 ' HG2' ' A' ' 26' ' ' GLU . 0.1 OUTLIER -84.87 156.84 3.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.008 -179.66 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.437 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 1.1 m-20 -71.36 156.36 39.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.744 -179.817 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.518 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 3.1 m120 -82.41 -22.8 35.21 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 121.266 0.555 . . . . 0.0 109.598 176.423 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -74.61 -37.33 62.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.325 0.583 . . . . 0.0 109.794 176.807 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.07 -22.57 58.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.304 179.348 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.736 HD11 ' HB2' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -63.04 -48.17 79.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.882 178.56 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.514 ' O ' ' HG3' ' A' ' 60' ' ' GLU . 53.1 tp -55.28 -43.79 75.08 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.347 179.01 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -58.41 -41.17 84.34 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.056 179.226 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.505 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 24.4 mmt -60.12 -36.69 78.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.058 179.687 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.506 HD13 ' NE ' ' A' ' 27' ' ' ARG . 8.3 tt -70.9 -19.83 62.56 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.286 -179.19 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.514 ' HG3' ' O ' ' A' ' 56' ' ' LEU . 13.7 mt-10 -106.53 -3.72 20.52 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 -178.607 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.531 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.3 OUTLIER -122.52 83.08 47.44 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 120.602 0.239 . . . . 0.0 111.213 -179.447 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -59.94 -31.93 94.38 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.312 2.008 . . . . 0.0 111.945 179.237 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -78.09 -49.01 14.76 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.498 -179.793 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 47.4 m -70.58 -52.78 19.22 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.889 0.376 . . . . 0.0 111.439 -178.63 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.683 HD23 HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -57.93 -62.24 1.95 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.26 -178.704 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.541 ' HA ' ' HE2' ' A' ' 35' ' ' MET . 0.5 OUTLIER -50.71 -35.77 32.9 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.157 -177.831 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.595 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 4.2 m -67.96 -36.21 79.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.292 0.568 . . . . 0.0 110.049 178.127 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.58 ' HG2' HD22 ' B' ' 6' ' ' LEU . 9.7 ttpt -66.12 -57.67 7.15 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.11 178.556 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.775 ' HA ' ' HB3' ' A' ' 72' ' ' ALA . 42.0 t -65.21 -15.64 18.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.373 178.572 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.595 ' HB3' ' O ' ' A' ' 67' ' ' SER . 9.4 t70 -57.3 -48.98 77.55 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 176.313 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.434 ' O ' HG11 ' A' ' 75' ' ' VAL . 4.5 tt0 -68.6 -21.97 64.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.673 176.515 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.775 ' HB3' ' HA ' ' A' ' 69' ' ' VAL . . . -63.95 -51.17 65.62 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.817 179.597 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.769 ' HA ' HD13 ' A' ' 43' ' ' ILE . 2.6 m -56.15 -29.17 26.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 176.851 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.86 -32.47 69.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.055 178.64 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.67 HG21 ' HE3' ' A' ' 46' ' ' MET . 1.6 m -57.06 -33.48 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 178.515 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.734 HD13 ' HB2' ' A' ' 39' ' ' LEU . 39.0 mt -66.56 -48.3 70.1 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 175.96 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 17.1 mm100 -54.72 -36.79 65.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.315 178.916 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.89 -20.69 38.32 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.159 178.57 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 . . . . . 0 C--N 1.332 -0.165 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.902 -179.381 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' B' B ' 5' ' ' ASN . . . . . 0.411 ' HB3' ' HG2' ' A' ' 71' ' ' GLU . 0.3 OUTLIER . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.792 0.33 . . . . 0.0 111.029 . . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.58 HD22 ' HG2' ' A' ' 68' ' ' LYS . 1.4 tp -74.45 -77.85 0.11 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.014 -179.75 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 7' ' ' ASN . . . . . 0.541 HD21 ' H ' ' B' ' 9' ' ' ASN . 2.1 t30 -83.71 138.33 40.88 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.026 179.867 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . 0.473 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 5.6 Cg_exo -79.86 -7.78 14.44 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.75 2.3 . . . . 0.0 111.928 179.234 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 9' ' ' ASN . . . . . 0.56 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 64.8 m-20 -123.38 56.31 1.2 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.185 -179.76 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . 0.555 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.8 98.94 0.08 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.707 179.507 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.56 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.0 OUTLIER -124.99 156.47 38.05 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.471 178.446 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . 0.676 ' HG2' ' HE3' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -56.25 166.49 0.82 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.764 0.316 . . . . 0.0 111.416 -179.656 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' B' B ' 13' ' ' PHE . . . . . 0.685 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.1 t80 . . . . . 0 N--CA 1.463 0.176 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.681 179.84 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.537 ' HG3' ' NE2' ' A' ' 20' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.812 0.339 . . . . 0.0 110.849 . . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . 0.682 ' HD2' ' HB3' ' A' ' 48' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.936 -179.86 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.74 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 5.8 t . . . . . 0 CA--C 1.523 -0.091 0 CA-C-O 120.536 0.208 . . . . 0.0 110.886 . . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.488 ' N ' HG22 ' A' ' 8' ' ' THR . . . -59.23 -33.66 71.28 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 177.707 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -75.09 -34.98 61.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.94 177.574 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.743 ' HE2' ' HA ' ' A' ' 23' ' ' MET . 9.0 mtm -64.42 -36.78 85.28 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.898 177.869 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.605 HD12 ' HB3' ' A' ' 24' ' ' LEU . 1.2 mp -52.59 -56.28 16.39 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.906 178.626 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.29 -25.27 66.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.881 178.202 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.6 m -101.61 23.7 10.83 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.834 -178.534 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.568 ' HB1' ' HB2' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.753 -0.203 . . . . 0.0 111.161 179.545 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.568 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 1.9 mm-40 . . . . . 0 N--CA 1.448 -0.575 0 CA-C-O 120.514 0.197 . . . . 0.0 110.886 . . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.577 HE22 ' HG3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -46.43 -61.0 2.0 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.223 -177.73 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.518 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -56.32 -25.02 47.44 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.293 -179.32 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.481 ' OE1' ' HG3' ' A' ' 23' ' ' MET . 2.9 tt0 -73.44 -75.56 0.14 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.844 0.354 . . . . 0.0 111.52 179.468 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 23' ' ' MET . . . . . 0.743 ' HA ' ' HE2' ' A' ' 11' ' ' MET . 0.0 OUTLIER -69.15 -96.58 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -176.309 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.608 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -61.96 0.73 0.35 Allowed 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 -175.532 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 65.0 -117.29 10.11 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 108.421 -1.872 . . . . 0.0 108.421 -174.322 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.788 ' HG3' HD23 ' A' ' 55' ' ' LEU . 1.2 mp0 -75.91 -68.54 0.57 Allowed 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 169.401 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.814 ' HG2' HD23 ' A' ' 59' ' ' LEU . 1.7 tpt180 -160.06 11.75 0.12 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.216 175.537 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.604 ' HA ' HD12 ' A' ' 31' ' ' LEU . 4.1 mm? -57.2 -78.45 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.608 -1.178 . . . . 0.0 113.49 -173.302 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.624 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -35.05 -48.33 1.04 Allowed Pre-proline 0 CA--C 1.539 0.521 0 N-CA-C 113.642 0.978 . . . . 0.0 113.642 -175.517 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.542 ' HG2' ' HD2' ' A' ' 27' ' ' ARG . 46.8 Cg_exo -59.69 -42.16 49.11 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 122.367 2.045 . . . . 0.0 113.736 -178.204 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.604 HD12 ' HA ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -70.61 -44.54 67.06 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 121.131 0.491 . . . . 0.0 109.97 -178.474 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.604 HG12 HG12 ' A' ' 69' ' ' VAL . 0.2 OUTLIER -76.9 -13.0 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.968 178.179 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.606 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 49.6 tp60 -62.33 -37.47 85.72 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 176.75 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.47 -32.5 71.46 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.139 174.749 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 35' ' ' MET . . . . . 0.589 ' SD ' HG11 ' A' ' 69' ' ' VAL . 7.0 mtt -100.13 28.75 4.68 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.203 177.85 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.606 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.2 OUTLIER -63.16 -32.15 8.1 Favored Pre-proline 0 CA--C 1.535 0.402 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -177.429 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.548 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 60.0 Cg_exo -36.65 -32.85 0.13 Allowed 'Trans proline' 0 C--N 1.362 1.275 0 C-N-CA 122.083 1.855 . . . . 0.0 112.27 179.23 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 86.6 m -78.26 -88.08 0.05 Allowed 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.8 176.836 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.66 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 0.1 OUTLIER -171.35 61.17 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.447 178.203 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.458 ' HB3' ' O ' ' A' ' 32' ' ' ILE . . . -44.99 -34.24 2.36 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.848 0.356 . . . . 0.0 111.616 179.661 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.624 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -50.94 -58.16 9.88 Favored Glycine 0 C--N 1.33 0.243 0 CA-C-N 115.989 -0.551 . . . . 0.0 113.867 -178.995 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.443 ' HA ' ' HD3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -77.86 -34.35 51.74 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -177.867 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.675 HD13 ' HA ' ' A' ' 73' ' ' VAL . 36.1 mt -55.98 -55.43 18.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.715 -0.22 . . . . 0.0 111.481 -179.008 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.53 HG22 ' CD2' ' A' ' 29' ' ' PHE . 6.1 t -47.56 -44.18 25.91 Favored 'General case' 0 CA--C 1.522 -0.119 0 CA-C-O 121.006 0.432 . . . . 0.0 110.135 178.637 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.796 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -49.65 -65.39 2.85 Favored Glycine 0 N--CA 1.448 -0.501 0 CA-C-N 115.312 -0.858 . . . . 0.0 113.464 -179.862 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.736 ' HE1' HG21 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -55.33 -50.72 68.88 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -177.276 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.48 ' HA ' HD12 ' A' ' 47' ' ' LEU . 2.9 mm? -79.06 6.2 10.04 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -177.917 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.553 ' O ' HD12 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -66.21 -7.65 19.55 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.984 0.421 . . . . 0.0 110.622 179.195 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.435 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 3.3 mt-10 -81.96 16.8 1.75 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.664 178.437 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.403 HG21 ' HG2' ' A' ' 26' ' ' GLU . 0.5 OUTLIER -83.16 158.82 3.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.816 -179.514 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -70.59 160.05 33.23 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.02 0.438 . . . . 0.0 111.838 -178.089 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.539 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 4.9 m120 -83.67 -31.39 26.17 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.448 178.738 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.1 t -74.01 -34.27 64.1 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.387 0.613 . . . . 0.0 109.523 177.516 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.443 ' HG3' ' N ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -75.58 -28.65 59.03 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.645 179.367 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.788 HD23 ' HG3' ' A' ' 26' ' ' GLU . 0.7 OUTLIER -59.34 -47.07 86.79 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 120.923 0.392 . . . . 0.0 110.003 179.124 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.75 ' HA ' HD21 ' A' ' 59' ' ' LEU . 2.2 tm? -56.33 -48.04 77.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.926 -179.844 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.428 ' O ' ' HB2' ' A' ' 61' ' ' SER . 15.4 t60 -58.05 -24.67 59.33 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.918 -179.119 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.582 ' HE1' ' HA ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -73.86 -58.17 3.48 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -177.542 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.814 HD23 ' HG2' ' A' ' 27' ' ' ARG . 2.2 pt? -65.59 -6.03 9.9 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.962 -179.024 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.518 ' HG3' HD11 ' A' ' 56' ' ' LEU . 13.4 mm-40 -106.68 -10.86 15.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.679 177.455 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.568 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.5 OUTLIER -122.5 97.83 44.3 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.137 179.75 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -64.06 -30.53 66.07 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.201 1.934 . . . . 0.0 112.028 179.07 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -78.22 -51.26 10.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.599 -179.7 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.435 ' HB3' ' HB3' ' A' ' 61' ' ' SER . 33.2 t -69.07 -44.65 72.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.686 -178.033 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.582 ' HA ' ' HE1' ' A' ' 58' ' ' MET . 0.2 OUTLIER -69.86 -62.14 1.5 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.986 -177.136 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.419 ' O ' ' HB2' ' A' ' 70' ' ' ASP . 0.0 OUTLIER -51.15 -29.28 13.13 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.962 -177.646 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.456 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.4 OUTLIER -69.59 -39.53 77.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.138 0.494 . . . . 0.0 110.233 178.013 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.412 ' HE3' ' OE2' ' A' ' 54' ' ' GLU . 5.0 mtmm -65.49 -61.05 2.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.236 178.862 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.81 ' HA ' ' HB3' ' A' ' 72' ' ' ALA . 53.0 t -61.78 -20.95 24.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.942 -179.416 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.595 ' O ' HG23 ' A' ' 73' ' ' VAL . 16.5 t70 -54.63 -51.76 64.39 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 176.458 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.444 ' O ' HG13 ' A' ' 75' ' ' VAL . 0.5 OUTLIER -69.23 -26.3 64.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.017 177.003 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.81 ' HB3' ' HA ' ' A' ' 69' ' ' VAL . . . -61.17 -48.2 82.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.04 179.952 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.675 ' HA ' HD13 ' A' ' 43' ' ' ILE . 2.6 m -58.48 -31.58 43.66 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 177.541 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.418 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -68.16 -37.92 81.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.145 178.952 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.736 HG21 ' HE1' ' A' ' 46' ' ' MET . 1.0 OUTLIER -60.61 -31.17 48.38 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.217 0 CA-C-O 120.919 0.39 . . . . 0.0 110.225 179.511 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.66 ' HG ' ' HB3' ' A' ' 39' ' ' LEU . 2.3 tm? -71.41 -49.54 40.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.215 178.803 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 9.7 mm100 -57.62 -37.64 73.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.457 179.214 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.29 -21.78 39.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.905 -0.588 . . . . 0.0 111.067 179.293 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 11.9 t-80 . . . . . 0 C--N 1.331 -0.237 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.025 -179.534 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 11.9 m120 . . . . . 0 C--O 1.232 0.169 0 CA-C-O 120.86 0.362 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.447 ' HB3' HD13 ' A' ' 47' ' ' LEU . 7.5 tp -68.87 -77.53 0.08 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.112 178.182 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 7' ' ' ASN . . . . . 0.452 ' HA ' ' HD3' ' B' ' 8' ' ' PRO . 1.1 t30 -92.08 127.6 48.72 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.327 177.768 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 6.6 Cg_exo -73.77 -2.12 11.76 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.281 1.987 . . . . 0.0 112.177 -179.717 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 9' ' ' ASN . . . . . 0.403 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 8.3 m-20 -123.76 40.31 3.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.042 -179.774 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.1 92.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.508 -179.383 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.471 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -121.37 136.23 54.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.946 179.125 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -47.67 168.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -177.905 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 13' ' ' PHE . . . . . 0.796 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.6 OUTLIER . . . . . 0 C--O 1.233 0.185 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.783 179.171 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.577 ' HG3' HE22 ' A' ' 20' ' ' GLN . 1.8 mppt? . . . . . 0 C--O 1.231 0.12 0 CA-C-O 121.012 0.434 . . . . 0.0 110.556 . . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . 0.471 ' CE2' ' HG2' ' B' ' 11' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.101 -178.922 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.74 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 9.9 t . . . . . 0 CA--C 1.522 -0.122 0 CA-C-O 120.637 0.256 . . . . 0.0 110.559 . . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.496 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.18 -36.57 75.56 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 177.175 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 35.2 t -71.4 -34.19 70.15 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.625 177.003 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.74 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 5.3 mtm -64.32 -34.31 77.84 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 177.347 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.617 HD11 ' SD ' ' A' ' 23' ' ' MET . 3.4 mp -52.54 -52.61 53.97 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.902 178.481 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.09 -25.51 67.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.895 178.414 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.6 p -101.93 13.23 35.37 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.846 -178.676 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.563 ' HB3' ' O ' ' A' ' 11' ' ' MET . . . . . . . . 0 CA--C 1.534 0.339 0 CA-C-O 120.528 0.204 . . . . 0.0 111.29 -179.871 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.574 ' HB3' ' HE1' ' A' ' 23' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.205 0 CA-C-O 120.912 0.387 . . . . 0.0 110.676 . . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -47.07 -67.27 0.29 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.521 -179.14 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.578 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.79 -21.21 18.12 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.814 -177.706 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.578 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 10.3 tt0 -73.52 -78.32 0.1 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.006 0.431 . . . . 0.0 111.254 179.177 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 23' ' ' MET . . . . . 0.617 ' SD ' HD11 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.25 -95.99 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -176.909 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.65 HD11 HH11 ' A' ' 27' ' ' ARG . 0.3 OUTLIER -61.63 -1.32 0.56 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -175.323 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.588 ' O ' HD21 ' A' ' 24' ' ' LEU . . . 64.38 -117.41 10.61 Favored Glycine 0 CA--C 1.505 -0.569 0 N-CA-C 108.262 -1.935 . . . . 0.0 108.262 -174.6 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.42 ' HG3' ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -76.45 -67.59 0.68 Allowed 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 107.143 -1.428 . . . . 0.0 107.143 168.049 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.65 HH11 HD11 ' A' ' 24' ' ' LEU . 1.6 tpt180 -159.71 10.54 0.12 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 114.364 -1.289 . . . . 0.0 108.614 175.302 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.745 ' HA ' HD12 ' A' ' 31' ' ' LEU . 3.8 mm? -56.91 -84.84 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.655 -1.157 . . . . 0.0 113.929 -172.924 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.569 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -31.14 -51.09 0.43 Allowed Pre-proline 0 CA--C 1.539 0.535 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -174.833 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.61 ' HG2' ' HB2' ' A' ' 24' ' ' LEU . 54.1 Cg_exo -56.43 -42.75 62.37 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 122.238 1.959 . . . . 0.0 113.875 -178.178 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.745 HD12 ' HA ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -71.12 -44.06 66.38 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.112 0.482 . . . . 0.0 110.375 -178.232 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.786 HD11 ' HB ' ' A' ' 43' ' ' ILE . 0.0 OUTLIER -72.55 -20.64 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.708 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.127 179.254 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 62.8 tp60 -62.79 -31.45 72.43 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 175.684 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.33 -20.14 55.34 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 114.99 -1.004 . . . . 0.0 109.984 176.942 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 35' ' ' MET . . . . . 0.589 ' HG3' ' HA ' ' A' ' 32' ' ' ILE . 2.5 mtt -98.49 7.06 46.65 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.117 178.679 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -77.29 163.46 64.45 Favored Pre-proline 0 N--CA 1.447 -0.621 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.427 -179.75 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -100.85 90.05 0.08 OUTLIER 'Cis proline' 0 C--N 1.353 0.769 0 C-N-CA 124.535 -1.027 . . . . 0.0 113.49 4.078 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 6.5 m -98.99 -70.36 0.73 Allowed 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 176.163 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.591 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 2.9 tp -171.76 28.62 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.157 176.887 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.581 ' HB2' ' HB ' ' A' ' 32' ' ' ILE . . . -33.6 -38.96 0.05 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.046 -179.272 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.569 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -52.26 -53.0 33.3 Favored Glycine 0 C--N 1.33 0.238 0 C-N-CA 121.052 -0.594 . . . . 0.0 113.048 179.61 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.514 ' HD2' ' HG2' ' B' ' 12' ' ' GLU . 0.0 OUTLIER -78.16 -34.14 49.9 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 122.676 -0.308 . . . . 0.0 111.427 -179.725 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.786 ' HB ' HD11 ' A' ' 32' ' ' ILE . 1.8 mt -54.14 -57.98 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-O 120.583 0.23 . . . . 0.0 110.789 179.979 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.497 HG21 ' N ' ' A' ' 45' ' ' GLY . 10.0 t -47.76 -46.03 29.73 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.078 178.558 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.559 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -50.15 -66.49 2.32 Favored Glycine 0 N--CA 1.449 -0.462 0 CA-C-N 115.608 -0.724 . . . . 0.0 113.214 179.838 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.527 ' HB2' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.47 -51.68 66.14 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -177.648 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.515 ' N ' HD21 ' A' ' 47' ' ' LEU . 2.8 mm? -79.35 8.33 6.33 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -177.975 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.559 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.13 -6.82 14.57 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.08 0.467 . . . . 0.0 110.334 178.676 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.465 ' OE2' ' HB3' ' B' ' 11' ' ' LYS . 3.3 mt-10 -81.66 16.06 1.91 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.607 178.698 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.744 HD12 ' NZ ' ' A' ' 68' ' ' LYS . 0.9 OUTLIER -83.18 160.25 3.58 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.633 -179.729 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.519 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 34.4 m-20 -70.99 154.98 41.36 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.97 0.414 . . . . 0.0 112.036 -178.16 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.495 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 1.1 t-20 -82.99 -31.08 27.72 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.034 177.995 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.2 t -73.97 -33.46 63.87 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.344 0.592 . . . . 0.0 109.477 177.592 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.519 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -75.38 -27.82 59.25 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.467 179.074 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.512 ' CD1' ' HB2' ' A' ' 27' ' ' ARG . 0.6 OUTLIER -59.64 -47.82 84.08 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.189 179.432 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.423 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 12.2 tp -56.54 -46.27 80.76 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.623 179.361 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -59.75 -32.67 70.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.28 179.882 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.515 ' SD ' ' HE2' ' A' ' 68' ' ' LYS . 32.0 mmt -60.87 -51.61 68.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.432 -179.4 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.597 HD23 ' NE ' ' A' ' 27' ' ' ARG . 0.2 OUTLIER -61.61 -22.23 65.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.081 -179.057 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -99.75 -3.64 32.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.8 179.954 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.572 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 16.0 m -122.72 80.64 48.57 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.52 179.617 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.37 -35.69 95.97 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.147 1.898 . . . . 0.0 111.996 179.85 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.586 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.67 -45.19 21.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.718 -179.466 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.586 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 7.0 m -70.47 -51.98 25.27 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.952 0.406 . . . . 0.0 111.33 -178.079 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.618 HD21 HD23 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -58.12 -61.06 2.83 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.672 -178.755 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.614 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 1.1 ttp180 -48.39 -33.33 8.95 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.221 -177.436 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.424 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 8.2 t -61.67 -44.23 97.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.118 0.485 . . . . 0.0 110.277 178.307 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.744 ' NZ ' HD12 ' A' ' 50' ' ' ILE . 13.6 mtpp -65.92 -63.03 1.18 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.806 179.451 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.738 ' HA ' ' HB1' ' A' ' 72' ' ' ALA . 55.2 t -58.77 -19.45 14.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.089 -179.496 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.576 ' O ' HG23 ' A' ' 73' ' ' VAL . 20.4 t70 -58.19 -48.89 78.91 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 175.709 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.431 ' O ' HG11 ' A' ' 75' ' ' VAL . 3.5 tt0 -69.03 -27.23 65.48 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.817 176.603 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.78 ' HA ' HG13 ' A' ' 75' ' ' VAL . . . -60.31 -54.39 46.31 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.178 179.485 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.648 ' HA ' HD12 ' A' ' 43' ' ' ILE . 3.3 m -55.08 -29.62 22.65 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 177.932 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.57 -36.37 65.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.618 179.794 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.78 HG13 ' HA ' ' A' ' 72' ' ' ALA . 1.1 m -56.26 -31.17 31.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 N-CA-C 109.713 -0.476 . . . . 0.0 109.713 179.493 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.645 HD23 HG12 ' A' ' 43' ' ' ILE . 4.4 mm? -72.21 -48.69 41.08 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.861 176.552 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 34.9 mm-40 -50.82 -34.38 27.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.316 177.906 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -82.18 -29.7 31.35 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.55 176.911 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 16.4 t-80 . . . . . 0 N--CA 1.462 0.169 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.979 -179.913 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 3.0 m120 . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.875 0.369 . . . . 0.0 110.433 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.403 HD21 ' HB3' ' A' ' 68' ' ' LYS . 1.9 tp -64.8 -83.19 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.472 178.949 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 7' ' ' ASN . . . . . 0.494 ' HB2' HD13 ' A' ' 47' ' ' LEU . 0.4 OUTLIER -82.47 113.06 41.67 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.441 178.301 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -66.41 -5.05 11.84 Favored 'Trans proline' 0 N--CA 1.463 -0.296 0 C-N-CA 122.122 1.882 . . . . 0.0 112.242 -179.728 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 69.0 m-20 -123.74 38.52 4.17 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.465 179.139 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . 0.527 ' HB1' ' HB2' ' A' ' 46' ' ' MET . . . -53.91 94.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.87 -178.641 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.56 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -115.01 131.59 56.87 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.839 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . 0.514 ' HG2' ' HD2' ' A' ' 42' ' ' LYS . 6.7 mt-10 -50.0 178.97 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -177.204 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 13' ' ' PHE . . . . . 0.467 ' CE1' ' HG ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.519 -0.218 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.853 179.725 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.152 0 CA-C-O 121.075 0.464 . . . . 0.0 110.974 . . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . 0.56 ' CE2' ' HG2' ' B' ' 11' ' ' LYS . 2.1 t80 . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.067 -179.511 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.746 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 9.8 t . . . . . 0 N--CA 1.456 -0.151 0 CA-C-O 120.685 0.279 . . . . 0.0 110.435 . . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.426 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.22 -36.23 75.05 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 177.068 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 5.4 t -68.98 -35.74 77.06 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.746 177.101 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.746 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 5.4 mtm -64.39 -35.92 82.46 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.943 177.769 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.746 HD13 ' HB3' ' A' ' 24' ' ' LEU . 4.2 mp -52.31 -48.48 65.37 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.07 178.921 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.97 -30.17 70.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.836 178.312 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.468 ' HG ' ' HA ' ' A' ' 11' ' ' MET . 4.9 p -101.71 21.56 14.26 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.716 -179.012 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.605 ' HB2' ' O ' ' A' ' 11' ' ' MET . . . . . . . . 0 CA--C 1.532 0.277 0 CA-C-O 120.555 0.217 . . . . 0.0 111.319 179.875 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.534 ' O ' ' HB3' ' A' ' 22' ' ' GLN . 2.1 mm-40 . . . . . 0 N--CA 1.449 -0.483 0 CA-C-O 120.604 0.24 . . . . 0.0 110.727 . . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.531 HE22 ' HG2' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -46.04 -70.1 0.11 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.122 -179.078 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.429 ' H ' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -55.6 -18.59 7.99 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.651 -177.668 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.534 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 10.8 tp60 -73.95 -79.22 0.09 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.909 0.385 . . . . 0.0 111.457 178.223 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 23' ' ' MET . . . . . 0.647 ' HA ' ' HE1' ' A' ' 11' ' ' MET . 0.0 OUTLIER -69.17 -94.9 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.984 -0.553 . . . . 0.0 112.412 -176.775 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.746 ' HB3' HD13 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -59.45 0.52 0.12 Allowed 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -176.588 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.482 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.36 -118.85 13.69 Favored Glycine 0 CA--C 1.501 -0.84 0 N-CA-C 107.979 -2.048 . . . . 0.0 107.979 -174.384 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.508 ' HG2' HD21 ' A' ' 52' ' ' ASN . 29.0 mt-10 -77.26 -66.01 0.88 Allowed 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 167.659 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.763 ' HB2' HD13 ' A' ' 55' ' ' LEU . 2.5 tpt180 -160.22 9.51 0.1 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.095 -1.411 . . . . 0.0 108.472 174.76 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.876 HD13 ' HA ' ' A' ' 44' ' ' THR . 3.6 mm? -56.99 -80.42 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.732 -1.122 . . . . 0.0 113.681 -172.978 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.42 ' HA ' ' HG1' ' A' ' 44' ' ' THR . 0.1 OUTLIER -34.82 -48.71 1.01 Allowed Pre-proline 0 CA--C 1.538 0.505 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -174.445 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.648 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 50.5 Cg_exo -57.95 -42.85 54.1 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.15 1.9 . . . . 0.0 113.573 -178.972 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.625 HD22 HD12 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -71.86 -47.4 53.26 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.664 -178.328 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.605 ' HA ' ' HG3' ' A' ' 35' ' ' MET . 0.0 OUTLIER -69.76 -18.22 21.91 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 C-N-CA 120.614 -0.434 . . . . 0.0 109.938 178.86 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.463 ' HB3' ' O ' ' A' ' 30' ' ' PRO . 36.4 tp60 -62.88 -34.14 76.76 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 174.136 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -74.16 -19.12 60.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 114.775 -1.102 . . . . 0.0 110.128 176.816 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 35' ' ' MET . . . . . 0.605 ' HG3' ' HA ' ' A' ' 32' ' ' ILE . 0.1 OUTLIER -98.66 -3.42 36.08 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.892 178.22 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.451 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -62.51 166.05 7.98 Favored Pre-proline 0 N--CA 1.448 -0.568 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.247 -179.951 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.416 ' HA ' ' CB ' ' A' ' 36' ' ' HIS . 69.6 Cg_endo -103.7 61.3 0.62 Allowed 'Cis proline' 0 N--CA 1.455 -0.747 0 C-N-CA 124.69 -0.962 . . . . 0.0 113.959 5.158 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 52.7 m -77.04 -73.8 0.28 Allowed 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 176.793 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.713 ' HB2' HD22 ' A' ' 76' ' ' LEU . 0.2 OUTLIER -171.95 49.5 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.848 176.428 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.497 ' CB ' ' HB ' ' A' ' 32' ' ' ILE . . . -41.47 -34.63 0.57 Allowed 'General case' 0 N--CA 1.462 0.13 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.582 179.907 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -54.3 -71.99 0.62 Allowed Glycine 0 N--CA 1.452 -0.28 0 CA-C-N 116.083 -0.508 . . . . 0.0 113.692 -179.207 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.527 ' O ' ' HG2' ' A' ' 46' ' ' MET . 0.0 OUTLIER -57.57 -41.85 81.91 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -177.074 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.485 ' HB ' HD13 ' A' ' 32' ' ' ILE . 22.7 mt -53.31 -57.4 4.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 121.079 0.466 . . . . 0.0 110.195 179.262 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.876 ' HA ' HD13 ' A' ' 28' ' ' LEU . 1.3 m -47.64 -45.78 28.19 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.247 177.475 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.727 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -51.25 -60.7 6.92 Favored Glycine 0 N--CA 1.445 -0.71 0 CA-C-N 115.06 -0.973 . . . . 0.0 113.231 -179.623 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.555 ' HB3' ' HB2' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -54.41 -59.47 4.65 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.746 0.307 . . . . 0.0 111.779 -177.473 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.705 HD23 ' HB2' ' B' ' 7' ' ' ASN . 1.1 mp -79.9 18.23 0.84 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.162 0.431 . . . . 0.0 112.162 -176.742 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.578 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.01 -6.94 14.42 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.301 0.572 . . . . 0.0 109.582 175.659 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.494 ' OE1' ' HB3' ' B' ' 9' ' ' ASN . 2.6 mt-10 -93.24 25.35 3.37 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.756 179.462 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.501 HD12 ' NZ ' ' A' ' 68' ' ' LYS . 3.5 tt -83.0 176.23 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.782 -179.72 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.722 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 7.0 m-20 -73.53 124.47 25.94 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.705 0.261 . . . . 0.0 111.705 179.441 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.657 ' HA ' HD21 ' A' ' 55' ' ' LEU . 3.7 t-20 -66.14 -30.54 71.05 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.448 0.642 . . . . 0.0 109.722 177.521 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.6 m -73.31 -33.19 65.03 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.838 177.612 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.722 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 3.9 mm-40 -76.96 -24.4 52.31 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.449 178.81 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.763 HD13 ' HB2' ' A' ' 27' ' ' ARG . 0.6 OUTLIER -59.08 -47.93 83.46 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 179.515 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.465 HD21 ' HA ' ' A' ' 56' ' ' LEU . 0.3 OUTLIER -59.45 -42.33 91.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.779 178.174 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.496 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 26.6 m-70 -69.27 -19.03 63.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.243 179.321 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.535 ' HG2' ' O ' ' A' ' 54' ' ' GLU . 23.8 mmt -68.66 -58.97 3.48 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.053 -179.576 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.707 HD11 ' NE ' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -61.51 -21.02 63.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.103 -179.577 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.496 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 0.6 OUTLIER -91.62 -9.57 43.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.085 179.817 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.54 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.5 OUTLIER -122.92 85.25 50.41 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.799 179.696 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_exo -59.88 -33.52 95.85 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.398 2.065 . . . . 0.0 112.292 -179.666 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.644 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.22 -45.8 22.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.297 -179.395 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.644 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 10.7 m -70.62 -54.16 13.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.83 0.348 . . . . 0.0 111.328 -178.695 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.625 HD12 HD22 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -57.82 -61.99 2.13 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.866 -178.286 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.624 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -48.53 -35.29 12.92 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.055 -177.256 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.15 -44.01 97.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.155 0.502 . . . . 0.0 110.154 178.45 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.501 ' NZ ' HD12 ' A' ' 50' ' ' ILE . 29.4 mtpt -66.3 -62.21 1.6 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.114 179.619 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.819 ' HA ' ' HB3' ' A' ' 72' ' ' ALA . 45.4 t -59.8 -21.29 21.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.187 -178.871 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.485 ' O ' HG21 ' A' ' 73' ' ' VAL . 18.5 t70 -58.34 -48.52 80.31 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 176.412 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.49 ' O ' ' HB2' ' A' ' 74' ' ' ALA . 0.8 OUTLIER -69.04 -25.61 64.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.597 176.557 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.819 ' HB3' ' HA ' ' A' ' 69' ' ' VAL . . . -62.2 -53.15 59.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.015 -179.908 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.485 HG21 ' O ' ' A' ' 70' ' ' ASP . 11.1 m -57.41 -26.28 26.0 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 177.684 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.49 ' HB2' ' O ' ' A' ' 71' ' ' GLU . . . -73.18 -36.84 66.64 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.187 178.618 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.616 HG11 ' HA ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.04 -37.65 62.71 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.147 0 CA-C-O 120.896 0.379 . . . . 0.0 110.051 179.458 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.713 HD22 ' HB2' ' A' ' 39' ' ' LEU . 0.5 OUTLIER -71.8 -43.11 66.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.081 177.961 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 54.7 mm-40 -52.85 -38.51 61.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.732 178.624 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.69 -26.02 35.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.302 177.151 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 18.2 t60 . . . . . 0 C--N 1.331 -0.196 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.039 -179.886 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 . . . . . 0 C--O 1.232 0.166 0 CA-C-O 120.773 0.321 . . . . 0.0 110.896 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.43 HD11 ' HG2' ' A' ' 68' ' ' LYS . 0.4 OUTLIER -62.7 -80.89 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.622 179.532 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' B' B ' 7' ' ' ASN . . . . . 0.705 ' HB2' HD23 ' A' ' 47' ' ' LEU . 1.0 OUTLIER -87.02 117.43 68.62 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.831 179.193 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -73.77 6.37 2.89 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.314 2.01 . . . . 0.0 111.957 179.619 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 9' ' ' ASN . . . . . 0.494 ' HB3' ' OE1' ' A' ' 49' ' ' GLU . 71.5 m-20 -123.08 38.73 4.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.83 179.92 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . 0.555 ' HB2' ' HB3' ' A' ' 46' ' ' MET . . . -59.37 88.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.961 -179.189 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.477 ' HG3' ' CD ' ' A' ' 49' ' ' GLU . 12.8 mttp -112.73 123.36 50.12 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 177.553 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -47.19 171.11 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -176.668 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 13' ' ' PHE . . . . . 0.727 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.2 OUTLIER . . . . . 0 CA--C 1.521 -0.15 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.714 179.529 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.531 ' HG2' HE22 ' A' ' 20' ' ' GLN . 33.2 mttt . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.9 0.381 . . . . 0.0 110.571 . . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.327 -0.374 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.047 -179.166 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.797 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 11.7 t . . . . . 0 CA--C 1.52 -0.181 0 CA-C-O 120.654 0.264 . . . . 0.0 110.339 . . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.68 -36.4 74.13 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 177.107 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.2 -36.26 71.84 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.785 177.341 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.797 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.4 mtm -64.45 -38.51 91.28 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.383 178.527 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 8' ' ' THR . 50.9 mt -52.45 -49.39 64.71 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.16 179.516 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.41 -32.38 73.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.184 178.233 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.78 27.72 6.23 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.81 -178.502 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.701 ' HB3' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.695 -0.229 . . . . 0.0 111.202 179.696 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.701 ' HB3' ' HB3' ' A' ' 15' ' ' ALA . 2.7 tp10 . . . . . 0 N--CA 1.46 0.047 0 CA-C-O 120.611 0.243 . . . . 0.0 111.346 . . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.486 ' O ' HD12 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -54.41 -56.95 13.45 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.494 -178.86 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.58 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -55.94 -20.38 15.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.642 -177.963 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.426 HE21 ' HG3' ' A' ' 23' ' ' MET . 4.9 tt0 -73.0 -79.04 0.08 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.956 0.408 . . . . 0.0 111.453 179.533 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 23' ' ' MET . . . . . 0.633 ' HA ' ' HE1' ' A' ' 11' ' ' MET . 0.0 OUTLIER -69.93 -94.32 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -176.684 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.586 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -61.46 3.34 0.13 Allowed 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 -174.705 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.74 -117.78 11.18 Favored Glycine 0 N--CA 1.444 -0.778 0 N-CA-C 108.214 -1.954 . . . . 0.0 108.214 -174.475 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.448 ' HG2' ' O ' ' A' ' 51' ' ' ASP . 1.3 mp0 -76.07 -67.55 0.67 Allowed 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 168.987 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.569 ' NH1' ' HB2' ' A' ' 30' ' ' PRO . 0.0 OUTLIER -160.5 8.97 0.09 Allowed 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 114.258 -1.337 . . . . 0.0 108.086 176.466 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.609 HD23 ' HA ' ' A' ' 44' ' ' THR . 0.3 OUTLIER -59.66 -73.85 0.08 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.316 -1.311 . . . . 0.0 114.051 -173.889 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.562 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -35.27 -48.45 1.15 Allowed Pre-proline 0 CA--C 1.541 0.596 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -175.42 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.569 ' HB2' ' NH1' ' A' ' 27' ' ' ARG . 45.1 Cg_exo -59.65 -41.96 51.24 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.372 2.048 . . . . 0.0 113.387 -178.601 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.616 HD12 HG23 ' A' ' 69' ' ' VAL . 0.0 OUTLIER -70.33 -47.29 61.73 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 120.478 -0.489 . . . . 0.0 109.87 -178.957 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.822 HG12 HG11 ' A' ' 69' ' ' VAL . 0.3 OUTLIER -73.3 -13.69 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.652 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.096 178.505 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.617 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 4.3 tp60 -61.33 -41.7 97.46 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 177.531 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.25 -28.8 67.53 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.124 175.13 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 35' ' ' MET . . . . . 0.59 ' SD ' HG13 ' A' ' 69' ' ' VAL . 5.5 mtt -102.01 27.42 6.6 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.345 178.393 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.617 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -63.79 -31.59 6.62 Favored Pre-proline 0 CA--C 1.537 0.468 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -177.083 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.584 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 54.9 Cg_exo -34.63 -34.32 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.255 0 C-N-CA 122.25 1.967 . . . . 0.0 112.406 179.33 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 23.5 m -78.6 -88.08 0.06 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.79 176.638 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.438 ' CB ' ' HG ' ' A' ' 76' ' ' LEU . 0.1 OUTLIER -171.34 62.47 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.408 178.14 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.485 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -43.81 -41.14 4.84 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.653 179.586 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.562 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -50.87 -53.61 25.68 Favored Glycine 0 C--N 1.33 0.22 0 CA-C-N 116.02 -0.536 . . . . 0.0 113.807 -178.692 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.491 ' HE2' ' SD ' ' A' ' 46' ' ' MET . 0.4 OUTLIER -77.43 -39.09 48.08 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.826 0.313 . . . . 0.0 111.764 -177.969 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.586 HD12 ' HA ' ' A' ' 73' ' ' VAL . 31.2 mt -53.86 -56.97 6.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.5 0.19 . . . . 0.0 110.972 -179.19 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.609 ' HA ' HD23 ' A' ' 28' ' ' LEU . 10.0 t -50.76 -42.26 57.54 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.811 0.339 . . . . 0.0 110.418 178.808 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.633 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -50.62 -67.93 1.69 Allowed Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 115.953 -0.567 . . . . 0.0 112.981 -179.761 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.685 ' HE2' HG21 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -55.29 -46.37 76.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.789 0.295 . . . . 0.0 111.664 -178.723 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.614 HD12 ' HB2' ' B' ' 7' ' ' ASN . 3.2 mm? -80.18 6.52 11.52 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 111.537 0.199 . . . . 0.0 111.537 -179.166 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.633 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.1 OUTLIER -65.81 -10.74 40.46 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.064 0.459 . . . . 0.0 110.372 179.558 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.492 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.5 mm-40 -79.23 18.43 0.68 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.415 177.831 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.42 ' H ' ' C ' ' A' ' 48' ' ' LEU . 1.3 tt -83.3 160.75 3.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.175 -179.381 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.462 ' HB2' ' HG3' ' A' ' 54' ' ' GLU . 17.7 m-20 -71.15 160.29 33.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.938 -178.837 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.422 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 5.8 m120 -87.69 -29.61 20.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.995 177.349 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 67.9 m -72.72 -33.05 66.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.897 178.12 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.462 ' HG3' ' HB2' ' A' ' 51' ' ' ASP . 14.8 mt-10 -75.83 -28.05 58.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.612 179.041 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.499 HD11 ' HB2' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -59.64 -48.81 80.18 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.303 179.597 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.458 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 1.1 tm? -61.43 -37.0 81.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.409 179.322 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.509 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 4.8 m-70 -64.52 -35.98 82.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.259 178.428 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.544 ' HB3' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -66.01 -41.94 90.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.411 178.702 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.543 HD21 ' NE ' ' A' ' 27' ' ' ARG . 3.4 tp -69.69 -14.67 62.92 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.884 179.475 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.509 ' HG2' ' O ' ' A' ' 57' ' ' HIS . 5.0 pt-20 -106.77 -3.26 20.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.818 179.282 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.563 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 4.6 m -124.39 84.74 56.29 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.968 -179.548 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -60.35 -35.03 92.8 Favored 'Trans proline' 0 N--CA 1.464 -0.255 0 C-N-CA 122.214 1.943 . . . . 0.0 112.094 179.517 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.467 ' O ' ' HB2' ' A' ' 67' ' ' SER . 0.0 OUTLIER -78.81 -44.89 22.11 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.768 -179.419 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.542 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 12.8 m -74.22 -50.44 19.11 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.827 0.346 . . . . 0.0 111.539 -177.996 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.571 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -58.16 -64.96 0.73 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.118 -179.027 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.547 ' HA ' ' HE3' ' A' ' 35' ' ' MET . 0.6 OUTLIER -49.19 -33.87 13.38 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.793 0.33 . . . . 0.0 110.793 -178.801 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.583 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.6 OUTLIER -69.58 -37.03 76.8 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 121.057 0.456 . . . . 0.0 110.148 177.933 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.4 ttpt -65.76 -57.86 7.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.081 178.491 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.822 HG11 HG12 ' A' ' 32' ' ' ILE . 46.9 t -63.48 -19.28 23.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.781 178.925 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.618 ' O ' HG23 ' A' ' 73' ' ' VAL . 9.1 t70 -55.89 -49.59 72.99 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 176.708 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.404 ' O ' ' HB2' ' A' ' 74' ' ' ALA . 0.7 OUTLIER -69.02 -25.74 64.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.768 176.731 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.714 ' HB3' ' HA ' ' A' ' 69' ' ' VAL . . . -62.15 -44.25 97.03 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.937 179.758 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.618 HG23 ' O ' ' A' ' 70' ' ' ASP . 2.5 m -61.06 -31.71 50.71 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 177.419 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.404 ' HB2' ' O ' ' A' ' 71' ' ' GLU . . . -66.1 -38.5 88.38 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.039 178.946 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.685 HG21 ' HE2' ' A' ' 46' ' ' MET . 0.9 OUTLIER -58.72 -31.97 45.55 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.095 0 CA-C-O 121.001 0.429 . . . . 0.0 110.124 179.262 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.438 ' HG ' ' CB ' ' A' ' 39' ' ' LEU . 2.4 tm? -70.97 -46.77 61.77 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.943 178.177 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -52.86 -37.05 59.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.405 179.212 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.21 -22.61 38.69 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.844 178.819 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.426 ' HB3' ' O ' ' A' ' 76' ' ' LEU . 20.4 t-80 . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.714 179.598 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.752 0.31 . . . . 0.0 110.886 . . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 5.7 mt -69.66 -78.59 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.683 179.706 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 7' ' ' ASN . . . . . 0.614 ' HB2' HD12 ' A' ' 47' ' ' LEU . 1.0 OUTLIER -82.1 127.95 69.82 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.951 179.494 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . 0.474 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 2.9 Cg_exo -76.96 -6.06 16.4 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.525 2.15 . . . . 0.0 111.948 179.249 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 9' ' ' ASN . . . . . 0.515 ' H ' HD21 ' B' ' 7' ' ' ASN . 14.6 m120 -123.12 56.65 1.16 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.945 179.963 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.26 96.73 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.567 179.955 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.492 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 0.7 OUTLIER -122.21 131.21 53.82 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.499 178.785 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -49.31 171.83 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.068 0.461 . . . . 0.0 112.087 -178.787 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 13' ' ' PHE . . . . . 0.466 ' CE1' ' HG ' ' A' ' 48' ' ' LEU . 0.3 OUTLIER . . . . . 0 CA--C 1.518 -0.287 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.03 179.498 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.58 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.944 0.402 . . . . 0.0 110.815 . . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.893 -179.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.21 0 N-CA-C 112.487 -0.245 . . . . 0.0 112.487 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -75.41 -20.65 15.87 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.56 2.173 . . . . 0.0 112.278 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.4 mp -86.18 45.28 1.21 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.916 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -87.42 4.18 86.15 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.36 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.536 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.1 OUTLIER -77.4 -49.95 2.18 Favored Pre-proline 0 C--N 1.329 -0.297 0 N-CA-C 111.481 0.178 . . . . 0.0 111.481 179.989 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.536 ' HD2' ' N ' ' A' ' 5' ' ' SER . 44.4 Cg_endo -68.06 -158.73 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 122.106 1.871 . . . . 0.0 112.257 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.466 ' HB3' ' OE1' ' A' ' 33' ' ' GLN . 0.4 OUTLIER -91.21 -179.42 5.42 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.009 -179.68 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.829 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 9.0 t -87.94 -29.27 20.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.355 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.42 -37.77 78.93 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 176.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 42.5 t -69.44 -35.08 75.33 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.683 177.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.829 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.2 mtm -64.41 -38.61 91.65 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.117 178.223 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.678 ' HA ' ' HE2' ' A' ' 23' ' ' MET . 46.1 mt -52.42 -49.31 64.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.211 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.55 -30.53 70.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.146 178.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.445 ' HG ' ' HA ' ' A' ' 11' ' ' MET . 2.5 p -101.44 17.92 21.46 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.763 -178.473 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.628 ' HB3' ' HB3' ' A' ' 19' ' ' GLU . . . -138.19 116.46 9.5 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.067 -179.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.42 ' HD2' ' OE2' ' A' ' 19' ' ' GLU . 53.3 Cg_exo -53.17 167.77 0.69 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.678 2.252 . . . . 0.0 112.285 179.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -56.71 -33.59 94.2 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.367 2.044 . . . . 0.0 112.423 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 12.8 mp0 -71.77 -12.32 61.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.908 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.628 ' HB3' ' HB3' ' A' ' 15' ' ' ALA . 0.4 OUTLIER -85.19 14.17 5.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.023 -179.891 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.634 HE22 ' HB3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -51.52 -63.56 1.1 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.13 179.76 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.602 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -55.97 -19.55 12.87 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.643 -178.239 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.546 ' N ' ' HE2' ' A' ' 21' ' ' LYS . 24.1 tt0 -73.61 -80.48 0.07 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.085 0.469 . . . . 0.0 111.465 179.039 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.678 ' HE2' ' HA ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.8 -95.24 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.816 -176.807 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.721 HD11 ' HD3' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -60.47 -1.37 0.35 Allowed 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -175.522 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.541 ' O ' HD22 ' A' ' 24' ' ' LEU . . . 64.76 -116.04 8.52 Favored Glycine 0 N--CA 1.446 -0.68 0 N-CA-C 108.423 -1.871 . . . . 0.0 108.423 -174.653 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.71 ' HG3' HD23 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -75.97 -69.4 0.5 Allowed 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 168.765 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.775 ' HG3' HD21 ' A' ' 31' ' ' LEU . 0.5 OUTLIER -160.06 9.99 0.11 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.226 -1.352 . . . . 0.0 108.002 175.007 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.837 HD23 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.41 -74.88 0.06 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.146 -1.388 . . . . 0.0 114.012 -173.456 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.586 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -34.54 -49.2 0.97 Allowed Pre-proline 0 CA--C 1.537 0.465 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -175.754 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.58 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 52.1 Cg_exo -57.68 -44.68 39.14 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.297 1.998 . . . . 0.0 113.424 -179.025 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.775 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.75 -44.07 67.54 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.178 -178.371 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.697 HD11 ' HB ' ' A' ' 43' ' ' ILE . 0.3 OUTLIER -76.19 -12.72 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.13 178.021 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.63 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 3.2 tp60 -62.58 -37.41 86.09 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 176.37 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.78 -32.39 72.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.25 -0.887 . . . . 0.0 108.934 174.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.499 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 7.3 mtt -100.34 27.96 5.33 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.221 177.842 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.63 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 2.1 p-80 -63.77 -32.61 8.2 Favored Pre-proline 0 CA--C 1.536 0.442 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -177.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.538 ' CD ' ' N ' ' A' ' 36' ' ' HIS . 62.0 Cg_exo -38.24 -28.57 0.12 Allowed 'Trans proline' 0 C--N 1.362 1.244 0 C-N-CA 122.224 1.949 . . . . 0.0 112.229 179.412 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.869 HG23 HG13 ' A' ' 73' ' ' VAL . 7.1 m -78.08 -86.54 0.06 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.874 176.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.507 HD21 HD12 ' A' ' 76' ' ' LEU . 2.6 tp -171.46 49.7 0.02 OUTLIER 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.065 178.409 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.441 ' CA ' HG13 ' A' ' 43' ' ' ILE . . . -32.5 -46.5 0.14 Allowed 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 112.262 0.468 . . . . 0.0 112.262 -178.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.586 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -44.72 -59.12 4.45 Favored Glycine 0 C--N 1.33 0.216 0 CA-C-N 116.132 -0.485 . . . . 0.0 114.127 -178.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.719 ' HB3' HD13 ' A' ' 76' ' ' LEU . 0.5 OUTLIER -76.66 -27.08 55.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 117.032 0.416 . . . . 0.0 111.798 -177.646 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.717 HG12 HD22 ' A' ' 76' ' ' LEU . 0.9 OUTLIER -57.83 -56.34 16.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.735 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.837 ' HA ' HD23 ' A' ' 28' ' ' LEU . 12.3 t -50.54 -40.55 52.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.47 179.239 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.64 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -50.5 -68.41 1.46 Allowed Glycine 0 N--CA 1.451 -0.304 0 CA-C-N 115.913 -0.585 . . . . 0.0 113.28 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.42 ' H ' ' HG2' ' A' ' 46' ' ' MET . 0.0 OUTLIER -55.61 -49.34 73.05 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 122.809 -0.23 . . . . 0.0 111.493 -178.365 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.831 HD13 ' HB3' ' B' ' 6' ' ' LEU . 2.3 mm? -79.94 9.62 5.17 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -178.366 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.608 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.96 -22.01 66.45 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.946 0.403 . . . . 0.0 110.606 179.276 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.557 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 3.4 mm-40 -74.63 21.72 0.11 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.062 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.497 ' H ' ' C ' ' A' ' 48' ' ' LEU . 2.6 tt -83.24 165.1 2.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.795 179.584 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.472 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 20.4 m-20 -70.79 156.38 39.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.862 0.363 . . . . 0.0 111.573 -179.109 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.583 ' HA ' HD23 ' A' ' 55' ' ' LEU . 5.1 m120 -88.9 -28.24 20.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.778 177.391 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.4 t -74.03 -30.18 62.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.664 177.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.472 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 4.9 mm-40 -80.11 -26.9 39.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.592 178.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.71 HD23 ' HG3' ' A' ' 26' ' ' GLU . 0.8 OUTLIER -59.16 -46.61 87.93 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.872 0.368 . . . . 0.0 110.052 179.636 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.428 ' HA ' HD22 ' A' ' 56' ' ' LEU . 0.2 OUTLIER -64.4 -41.31 96.72 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.468 179.19 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.507 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 7.0 t60 -64.5 -30.39 71.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.267 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.67 ' HE2' ' HD3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -65.89 -45.24 82.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.869 -179.667 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.614 HD21 ' NE ' ' A' ' 27' ' ' ARG . 0.1 OUTLIER -66.38 -18.49 65.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.787 179.398 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.507 ' HG2' ' O ' ' A' ' 57' ' ' HIS . 4.1 pt-20 -100.14 -8.05 24.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.234 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.635 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.9 OUTLIER -125.38 88.1 54.68 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.946 179.737 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -60.06 -33.07 95.55 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.278 1.985 . . . . 0.0 112.23 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -78.0 -49.34 14.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.59 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 68.3 m -69.69 -32.24 70.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.888 0.375 . . . . 0.0 111.336 -178.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.635 ' HB3' ' O ' ' A' ' 61' ' ' SER . 1.1 tp -73.34 -65.23 0.84 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.598 -178.512 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.589 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -49.02 -29.67 5.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.186 -177.839 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.531 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.2 OUTLIER -65.43 -43.79 89.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.101 0.477 . . . . 0.0 110.286 178.292 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.67 ' HD3' ' HE2' ' A' ' 58' ' ' MET . 22.1 mtpt -65.86 -55.86 14.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.626 179.208 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.756 ' HA ' ' HB1' ' A' ' 72' ' ' ALA . 53.2 t -65.01 -19.74 26.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.662 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.531 ' HB3' ' O ' ' A' ' 67' ' ' SER . 7.2 t70 -55.83 -48.52 75.3 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 176.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -67.06 -33.97 76.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.637 176.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.756 ' HB1' ' HA ' ' A' ' 69' ' ' VAL . . . -55.55 -44.73 77.06 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.651 178.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.869 HG13 HG23 ' A' ' 38' ' ' THR . 11.7 t -60.0 -32.49 50.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.936 177.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.43 -36.38 65.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.629 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.705 HG11 ' HA ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.15 -28.84 35.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 120.922 0.391 . . . . 0.0 110.268 179.968 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.719 HD13 ' HB3' ' A' ' 42' ' ' LYS . 3.4 mm? -71.91 -54.32 10.39 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.802 178.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 25.5 mm100 -51.3 -36.63 43.35 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.469 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.48 -26.14 35.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.873 178.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.507 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 60.6 t60 -63.74 -45.77 88.35 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.21 -179.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -83.26 -12.76 56.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.092 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.84 -53.64 6.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.451 -179.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 23.8 mttp -77.04 -6.98 54.82 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.268 -179.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.507 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 6.5 tt0 -90.0 -39.46 12.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.113 -179.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -79.68 -27.56 40.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.2 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -84.11 30.69 0.51 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.239 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -81.1 -78.07 0.19 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.038 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -94.81 -17.13 22.39 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.985 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -87.24 53.77 2.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.166 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.0 p -103.38 117.5 48.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.939 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -104.48 -39.41 6.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.935 -179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -73.44 155.69 39.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.966 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.11 166.74 22.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.152 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 26.7 p -92.7 -178.17 4.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.837 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -77.2 149.36 35.64 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.479 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 5.4 m -91.58 148.19 36.84 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 120.547 0.213 . . . . 0.0 110.956 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -79.03 61.01 8.03 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.572 2.181 . . . . 0.0 112.44 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.2 p -87.98 107.78 18.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.951 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 5.8 t . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.075 -0.964 . . . . 0.0 111.068 -179.93 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 5.6 m . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.803 0.335 . . . . 0.0 111.041 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 3.5 t -97.8 98.0 6.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.989 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 10.6 mttm -91.69 132.06 36.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.91 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 5.9 t -88.24 175.56 7.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.955 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 -113.91 -48.34 2.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.944 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.831 ' HB3' HD13 ' A' ' 47' ' ' LEU . 17.6 tp -68.94 -76.53 0.09 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.777 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . 0.814 ' HB2' HD12 ' A' ' 47' ' ' LEU . 1.6 t30 -88.55 135.96 31.89 Favored Pre-proline 0 C--N 1.331 -0.197 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.856 179.38 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 5.7 Cg_exo -79.68 -3.65 13.01 Favored 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 122.73 2.287 . . . . 0.0 111.974 179.245 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' ASN . . . . . 0.575 ' H ' HD21 ' B' ' 7' ' ' ASN . 9.6 m-20 -123.16 51.09 1.48 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.174 -179.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . 0.407 ' HB3' ' HB3' ' A' ' 46' ' ' MET . . . -60.23 93.69 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.746 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.557 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 3.0 mttp -124.94 154.08 41.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.376 178.521 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -54.51 166.12 0.48 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.808 0.337 . . . . 0.0 111.316 -179.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' PHE . . . . . 0.64 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.1 t80 -88.37 107.85 19.05 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.761 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . 0.431 ' H ' HG22 ' B' ' 14' ' ' VAL . 1.1 m -111.21 90.6 11.91 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.552 178.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' PRO . . . . . 0.41 ' HD2' ' HA ' ' B' ' 14' ' ' VAL . 15.6 Cg_endo -55.82 -167.67 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.917 2.411 . . . . 0.0 112.921 -179.284 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . 0.424 ' C ' ' HD2' ' A' ' 21' ' ' LYS . . . 85.09 -50.0 4.32 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.906 -0.664 . . . . 0.0 112.307 -179.405 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 7.1 m -116.31 151.04 18.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.69 0.281 . . . . 0.0 111.013 178.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.634 ' HB3' HE22 ' A' ' 20' ' ' GLN . 0.2 OUTLIER -70.94 89.29 0.78 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.79 179.622 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -67.4 125.1 25.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.957 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 93.35 15.93 48.81 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.549 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -100.07 166.98 10.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.806 0.336 . . . . 0.0 110.917 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 3.9 mt . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.214 -0.898 . . . . 0.0 111.091 -179.968 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.168 0 N-CA-C 112.479 -0.248 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -55.28 -39.27 91.91 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.624 2.216 . . . . 0.0 112.189 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.46 -27.33 61.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.915 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.79 96.95 2.26 Favored Glycine 0 C--N 1.33 0.224 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.489 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.596 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.1 OUTLIER -80.59 -50.44 1.07 Allowed Pre-proline 0 CA--C 1.534 0.332 0 N-CA-C 111.537 0.199 . . . . 0.0 111.537 -179.96 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.596 ' HD2' ' N ' ' A' ' 5' ' ' SER . 19.3 Cg_endo -58.44 110.48 0.66 Allowed 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 122.224 1.95 . . . . 0.0 112.249 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 5.6 mt -94.49 -59.76 1.87 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.83 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.849 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 9.7 t -88.0 -32.49 18.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.404 -179.805 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.99 -34.49 71.9 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 177.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.82 -35.72 70.01 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.608 177.151 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.849 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 3.6 mtm -64.6 -38.09 89.83 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.189 177.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 8' ' ' THR . 68.8 mt -52.69 -50.78 62.64 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.003 179.463 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.5 -26.6 67.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.715 177.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.43 18.12 20.94 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.645 -178.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.633 ' HB3' ' O ' ' A' ' 11' ' ' MET . . . -134.38 59.18 35.05 Favored Pre-proline 0 CA--C 1.532 0.283 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.994 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.487 ' HD3' ' N ' ' A' ' 15' ' ' ALA . 52.8 Cg_exo -56.39 -49.71 14.22 Favored 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 122.79 2.327 . . . . 0.0 114.058 -178.156 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.452 ' HD2' ' N ' ' A' ' 16' ' ' PRO . 52.7 Cg_endo -68.76 -162.08 0.08 OUTLIER 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 121.946 1.764 . . . . 0.0 112.543 -178.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -73.53 69.69 1.24 Allowed 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.62 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.749 ' HG3' ' HB3' ' A' ' 22' ' ' GLN . 0.9 OUTLIER -104.48 8.23 35.53 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.029 -179.242 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.537 HE22 ' HG2' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -46.86 -61.37 1.89 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.286 -178.96 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.557 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -56.11 -25.11 44.57 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.685 -178.282 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.749 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 0.7 OUTLIER -73.26 -77.04 0.11 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.834 0.35 . . . . 0.0 111.627 179.921 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.718 ' HA ' ' HE1' ' A' ' 11' ' ' MET . 0.0 OUTLIER -68.99 -95.91 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -176.483 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.681 HD11 ' HD3' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -61.9 -1.8 0.73 Allowed 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -175.515 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.568 ' O ' HD22 ' A' ' 24' ' ' LEU . . . 64.8 -116.64 9.21 Favored Glycine 0 N--CA 1.446 -0.688 0 N-CA-C 108.535 -1.826 . . . . 0.0 108.535 -174.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.704 ' HG3' HD21 ' A' ' 55' ' ' LEU . 0.9 OUTLIER -76.13 -69.97 0.47 Allowed 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 169.052 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.681 ' HD3' HD11 ' A' ' 24' ' ' LEU . 7.4 tpt180 -159.96 13.52 0.13 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.4 -1.273 . . . . 0.0 108.044 175.566 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.634 ' HA ' HD13 ' A' ' 31' ' ' LEU . 4.1 mm? -57.3 -78.85 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.406 -1.27 . . . . 0.0 113.574 -173.439 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.634 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -36.05 -49.58 1.61 Allowed Pre-proline 0 CA--C 1.537 0.469 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -175.676 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.563 ' HG2' ' HD2' ' A' ' 27' ' ' ARG . 55.0 Cg_exo -55.29 -43.05 62.45 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.25 1.966 . . . . 0.0 113.611 -178.407 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.634 HD13 ' HA ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -71.18 -48.44 51.67 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.065 0.459 . . . . 0.0 110.336 -178.493 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.678 HG12 HG11 ' A' ' 69' ' ' VAL . 0.3 OUTLIER -71.87 -14.26 17.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.091 178.672 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.626 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.3 OUTLIER -62.24 -40.77 97.29 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 176.893 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.38 -30.51 71.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.166 174.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.621 ' HE2' ' HA ' ' A' ' 66' ' ' ARG . 5.7 mtt -103.15 27.2 7.4 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.394 178.48 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.626 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 2.4 p-80 -62.92 -32.55 9.05 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -177.486 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.555 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 57.2 Cg_exo -36.0 -32.94 0.11 Allowed 'Trans proline' 0 C--N 1.362 1.266 0 C-N-CA 122.221 1.948 . . . . 0.0 112.199 179.014 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 62.6 m -78.18 -88.38 0.05 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.83 176.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.588 ' HB2' HD13 ' A' ' 76' ' ' LEU . 0.1 OUTLIER -171.31 61.06 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.513 178.324 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.504 ' HB3' ' O ' ' A' ' 32' ' ' ILE . . . -47.02 -31.99 3.65 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.838 0.351 . . . . 0.0 111.508 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.634 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -43.24 -68.38 0.81 Allowed Glycine 0 CA--C 1.519 0.315 0 CA-C-N 115.697 -0.683 . . . . 0.0 114.597 -178.178 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.717 ' NZ ' ' HA ' ' B' ' 12' ' ' GLU . 0.7 OUTLIER -77.58 -29.16 51.92 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -176.809 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.742 HD12 ' HA ' ' A' ' 73' ' ' VAL . 37.6 mt -53.75 -52.16 37.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 121.157 -0.217 . . . . 0.0 111.378 -178.656 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.531 HG23 ' O ' ' A' ' 41' ' ' GLY . 5.6 t -48.17 -45.73 33.89 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.98 0.419 . . . . 0.0 110.293 178.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.706 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -52.07 -60.48 7.56 Favored Glycine 0 N--CA 1.453 -0.232 0 CA-C-N 115.623 -0.717 . . . . 0.0 113.76 -179.512 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.619 ' SD ' ' HE3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.74 -52.85 62.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.703 0.252 . . . . 0.0 111.52 -178.215 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.694 HD22 ' HB2' ' A' ' 72' ' ' ALA . 1.7 mm? -80.32 7.94 8.52 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -178.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.475 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.08 -15.15 62.83 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.922 0.391 . . . . 0.0 110.573 179.423 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -79.59 20.49 0.57 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.842 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.513 HG22 ' HG2' ' A' ' 26' ' ' GLU . 0.2 OUTLIER -83.43 161.43 3.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.745 -179.942 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.44 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 3.5 m-20 -68.27 157.06 36.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.821 -178.419 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.523 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 6.2 m120 -82.4 -31.42 29.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.149 178.037 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.48 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 1.0 OUTLIER -74.08 -30.86 62.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.348 0.594 . . . . 0.0 109.783 177.613 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.559 ' O ' ' HG2' ' A' ' 58' ' ' MET . 0.0 OUTLIER -78.77 -26.11 44.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.431 178.904 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.704 HD21 ' HG3' ' A' ' 26' ' ' GLU . 0.7 OUTLIER -61.42 -49.51 76.58 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.674 -179.885 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.572 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 1.2 pp -62.81 -39.02 92.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.956 0.407 . . . . 0.0 110.69 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.615 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 13.2 t60 -62.37 -20.38 64.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.959 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.644 ' HE3' ' HZ2' ' A' ' 68' ' ' LYS . 24.9 mmt -76.62 -51.58 11.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.115 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 56' ' ' LEU . 3.9 pp -64.48 -10.5 25.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.911 0.386 . . . . 0.0 110.429 179.22 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.615 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 0.0 OUTLIER -106.66 -8.22 17.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.747 179.501 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.597 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 3.3 m -122.82 79.93 49.39 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.203 -179.519 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -56.11 -32.75 87.94 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.161 1.907 . . . . 0.0 111.671 178.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -78.53 -51.54 9.81 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.891 -179.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.597 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 20.0 m -69.18 -52.07 31.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.951 0.405 . . . . 0.0 111.554 -177.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.626 HD21 HD11 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -57.81 -59.44 5.22 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.373 -178.535 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.621 ' HA ' ' HE2' ' A' ' 35' ' ' MET . 0.7 OUTLIER -50.02 -33.18 17.26 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.116 -177.949 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.585 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 6.5 t -68.23 -39.1 82.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.2 0.524 . . . . 0.0 110.255 178.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.644 ' HZ2' ' HE3' ' A' ' 58' ' ' MET . 1.6 ttpt -65.91 -59.12 4.16 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.434 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.809 ' HA ' ' HB1' ' A' ' 72' ' ' ALA . 42.1 t -62.57 -19.28 22.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.516 178.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.59 ' O ' HG21 ' A' ' 73' ' ' VAL . 18.5 t70 -54.88 -48.81 72.52 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 176.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -68.88 -26.85 65.33 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.503 -0.772 . . . . 0.0 109.844 176.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.809 ' HB1' ' HA ' ' A' ' 69' ' ' VAL . . . -63.68 -47.09 82.61 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.185 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.742 ' HA ' HD12 ' A' ' 43' ' ' ILE . 3.4 m -60.08 -28.87 42.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 177.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.39 -40.13 74.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.066 178.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.739 HG12 ' HA ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -55.61 -35.45 38.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 CA-C-O 121.102 0.477 . . . . 0.0 109.811 178.862 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.588 HD13 ' HB2' ' A' ' 39' ' ' LEU . 2.9 tm? -69.28 -47.28 65.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.754 177.673 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 20.1 mm-40 -52.07 -36.54 50.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.21 178.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.29 -27.46 35.06 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.63 178.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.404 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 79.1 t60 -64.19 -44.48 91.84 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.496 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -66.66 -19.65 65.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.819 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.1 -66.01 0.65 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.047 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 16.0 mttt -65.08 -18.45 65.32 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.088 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.404 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 1.9 tt0 -78.18 -49.31 14.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.063 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -79.51 -11.0 59.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.198 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -84.03 11.9 7.18 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.139 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -80.87 163.4 23.42 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.842 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 10.4 mttp -85.3 -176.16 6.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.009 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -83.4 7.57 16.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.09 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.4 t -77.4 140.07 17.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.021 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -85.7 86.63 7.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.814 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 66.9 m -80.06 -178.73 6.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.874 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.75 101.52 0.65 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.079 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 9.6 t -110.31 20.76 17.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.86 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -103.25 -138.04 9.72 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.574 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.2 p -84.74 132.05 47.58 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 120.621 0.248 . . . . 0.0 111.024 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -68.52 -175.67 0.95 Allowed 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.47 2.113 . . . . 0.0 112.191 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -82.88 87.86 6.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.962 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.006 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.978 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 21.6 m . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.789 0.328 . . . . 0.0 111.049 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.9 t -81.65 132.62 31.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.118 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 4.0 mmtm -86.92 109.45 19.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.904 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' SER . . . . . 0.474 ' HB3' ' O ' ' B' ' 7' ' ' ASN . 8.9 t -85.42 176.06 8.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.896 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -108.15 -48.75 3.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.98 -179.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.595 HD21 ' O ' ' A' ' 68' ' ' LYS . 5.3 tp -68.66 -74.78 0.12 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.865 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . 0.528 ' HB2' HD13 ' A' ' 47' ' ' LEU . 2.0 t30 -92.68 134.62 27.47 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.7 179.244 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -80.18 -4.17 13.04 Favored 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 122.297 1.998 . . . . 0.0 112.389 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' ASN . . . . . 0.506 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 18.0 m120 -123.28 50.9 1.51 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.852 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.96 96.06 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.219 -0.446 . . . . 0.0 112.068 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.0 OUTLIER -119.07 164.71 15.11 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.685 0.279 . . . . 0.0 110.477 177.445 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . 0.717 ' HA ' ' NZ ' ' A' ' 42' ' ' LYS . 0.7 OUTLIER -62.67 161.86 11.6 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.284 -179.352 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' PHE . . . . . 0.706 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.1 t80 -88.69 102.28 14.83 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.71 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 25.7 t -109.68 94.62 17.21 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.943 178.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' PRO . . . . . 0.415 ' HB3' ' HA ' ' A' ' 22' ' ' GLN . 11.8 Cg_endo -55.34 -169.86 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 122.959 2.439 . . . . 0.0 112.99 -178.258 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . 0.487 ' C ' ' HD2' ' A' ' 21' ' ' LYS . . . 85.66 -42.38 3.15 Favored Glycine 0 N--CA 1.452 -0.234 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.367 -179.228 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 30.8 m -116.53 150.03 18.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.737 0.303 . . . . 0.0 111.293 178.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.557 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 0.7 OUTLIER -72.48 97.3 2.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.622 179.378 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.1 114.42 4.62 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.777 -179.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 83.96 81.67 1.01 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.38 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 25.9 p30 -96.48 172.74 7.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.765 0.317 . . . . 0.0 111.11 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 1.1 pt . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.056 179.959 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.195 0 N-CA-C 112.554 -0.218 . . . . 0.0 112.554 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.46 -43.54 39.22 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.603 2.202 . . . . 0.0 112.225 -179.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 77.3 mt -72.42 -178.73 2.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.005 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -86.9 39.71 3.09 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.753 -179.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.442 ' HA ' ' O ' ' A' ' 6' ' ' PRO . 92.1 p -76.18 158.07 82.34 Favored Pre-proline 0 C--N 1.329 -0.295 0 N-CA-C 110.767 -0.086 . . . . 0.0 110.767 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.442 ' O ' ' HA ' ' A' ' 5' ' ' SER . 8.2 Cg_exo -71.39 -159.89 1.54 Allowed 'Cis proline' 0 C--N 1.35 0.657 0 C-N-CA 124.119 -1.2 . . . . 0.0 112.615 -1.638 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.445 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.2 OUTLIER -81.26 -161.84 0.45 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.066 179.908 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.752 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 15.3 t -87.91 -32.63 18.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.626 -179.544 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.45 ' N ' HG22 ' A' ' 8' ' ' THR . . . -58.82 -33.49 70.46 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.228 0.537 . . . . 0.0 109.628 177.448 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 14.3 t -74.1 -35.93 64.22 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.874 177.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.752 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.6 mtm -64.37 -36.48 84.26 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.038 177.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.514 ' HA ' ' HE3' ' A' ' 23' ' ' MET . 50.5 mt -53.02 -53.83 44.25 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.93 178.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.29 -25.14 66.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.667 177.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.9 t -101.56 24.65 9.43 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.706 -178.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.533 ' HB3' ' O ' ' A' ' 11' ' ' MET . . . -134.31 59.77 39.28 Favored Pre-proline 0 CA--C 1.533 0.302 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.915 179.462 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.477 ' HD3' ' N ' ' A' ' 15' ' ' ALA . 44.8 Cg_exo -58.0 -52.66 5.48 Favored 'Trans proline' 0 CA--C 1.538 0.709 0 C-N-CA 122.726 2.284 . . . . 0.0 113.938 -177.85 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.415 ' HD3' ' HB2' ' A' ' 16' ' ' PRO . 58.0 Cg_endo -70.31 -160.95 0.08 OUTLIER 'Trans proline' 0 C--N 1.355 0.912 0 C-N-CA 121.855 1.703 . . . . 0.0 112.308 -179.014 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -73.86 67.51 1.23 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.283 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.678 ' HG3' ' HB3' ' A' ' 22' ' ' GLN . 1.6 tp10 -104.34 6.78 35.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.985 -178.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.679 HE22 ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -47.33 -55.08 9.48 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.482 -178.725 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.679 ' HG3' HE22 ' A' ' 20' ' ' GLN . 0.0 OUTLIER -55.79 -26.4 45.89 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.779 -178.444 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.827 ' HA ' ' HB3' ' B' ' 15' ' ' PRO . 0.6 OUTLIER -72.47 -76.75 0.11 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.765 0.317 . . . . 0.0 111.643 -179.44 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.582 ' HA ' ' HE2' ' A' ' 11' ' ' MET . 0.0 OUTLIER -69.16 -96.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -176.841 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.596 HD22 HH11 ' A' ' 27' ' ' ARG . 0.4 OUTLIER -62.07 -1.95 0.81 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 113.596 0.962 . . . . 0.0 113.596 -175.219 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 65.05 -115.75 8.12 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 108.497 -1.841 . . . . 0.0 108.497 -174.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.802 ' HG3' HD22 ' A' ' 55' ' ' LEU . 0.5 OUTLIER -75.98 -69.9 0.47 Allowed 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 168.995 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.596 HH11 HD22 ' A' ' 24' ' ' LEU . 9.5 tpt180 -159.7 13.22 0.14 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 114.282 -1.326 . . . . 0.0 108.029 175.256 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.747 ' HA ' HD12 ' A' ' 31' ' ' LEU . 3.9 mm? -57.32 -76.46 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.513 -1.221 . . . . 0.0 113.506 -174.218 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.626 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -37.25 -49.87 2.36 Favored Pre-proline 0 CA--C 1.535 0.381 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -175.122 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.555 ' HG2' ' HD2' ' A' ' 27' ' ' ARG . 50.0 Cg_exo -56.71 -43.64 52.86 Favored 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 122.249 1.966 . . . . 0.0 113.64 -177.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.747 HD12 ' HA ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -70.66 -47.39 60.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.141 0.496 . . . . 0.0 110.185 -178.432 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.746 HD11 ' HB ' ' A' ' 43' ' ' ILE . 0.5 OUTLIER -75.36 -13.16 15.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.499 178.845 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.657 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 8.7 tp-100 -62.59 -39.55 94.07 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 177.025 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.55 -31.93 72.95 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.266 -0.879 . . . . 0.0 108.814 174.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.64 ' SD ' HG12 ' A' ' 69' ' ' VAL . 6.2 mtt -100.73 27.2 6.08 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.409 177.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.657 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.9 p-80 -64.06 -33.19 8.92 Favored Pre-proline 0 CA--C 1.535 0.399 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 -177.097 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.544 ' HD3' ' ND1' ' A' ' 36' ' ' HIS . 53.2 Cg_exo -37.11 -30.39 0.11 Allowed 'Trans proline' 0 C--N 1.361 1.187 0 C-N-CA 122.286 1.991 . . . . 0.0 112.36 179.557 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.508 HG23 HG11 ' A' ' 73' ' ' VAL . 90.2 m -78.28 -85.17 0.07 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.238 177.33 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.511 ' O ' HG13 ' A' ' 43' ' ' ILE . 7.9 tp -171.11 51.29 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.21 178.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.505 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -39.83 -38.18 0.64 Allowed 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.852 -179.547 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.626 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.08 -55.72 9.87 Favored Glycine 0 C--N 1.331 0.289 0 CA-C-N 116.096 -0.502 . . . . 0.0 114.012 -179.174 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.494 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -78.27 -34.27 49.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 117.098 0.449 . . . . 0.0 111.817 -178.654 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.747 HG12 HD22 ' A' ' 76' ' ' LEU . 0.9 OUTLIER -54.11 -55.84 12.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.613 0.245 . . . . 0.0 111.238 -179.083 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.507 HG21 ' CD2' ' A' ' 29' ' ' PHE . 5.2 t -47.22 -49.17 23.67 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.477 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.565 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -50.23 -51.44 30.98 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 121.092 -0.575 . . . . 0.0 112.901 179.149 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.497 ' H ' ' HG2' ' A' ' 46' ' ' MET . 3.1 mmm -55.72 -68.05 0.23 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.332 0.587 . . . . 0.0 111.364 -179.404 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.816 HD12 ' HB2' ' B' ' 6' ' ' LEU . 4.0 mm? -74.15 10.62 1.16 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.184 -0.917 . . . . 0.0 111.701 -177.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.514 ' HB3' ' HD2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -66.17 -24.39 66.64 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.972 0.415 . . . . 0.0 110.302 178.835 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.469 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 3.0 mt-10 -74.59 22.38 0.1 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.967 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.494 ' H ' ' C ' ' A' ' 48' ' ' LEU . 2.6 tt -83.63 166.87 2.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.76 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.437 ' HB2' ' HG3' ' A' ' 54' ' ' GLU . 7.6 m-20 -70.82 155.29 40.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.419 -179.422 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.613 ' HA ' HD22 ' A' ' 55' ' ' LEU . 4.8 m120 -83.21 -29.62 28.38 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.064 178.062 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.06 -31.88 63.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.747 177.547 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.437 ' HG3' ' HB2' ' A' ' 51' ' ' ASP . 6.1 mt-10 -79.46 -27.17 41.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.699 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.802 HD22 ' HG3' ' A' ' 26' ' ' GLU . 0.7 OUTLIER -59.47 -46.73 87.97 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.084 0.469 . . . . 0.0 109.925 179.123 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.486 ' O ' ' HG3' ' A' ' 60' ' ' GLU . 1.0 OUTLIER -61.2 -44.93 96.49 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.653 179.403 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 25.7 t60 -57.08 -40.33 76.7 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.055 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.711 ' HE2' ' HA ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -58.91 -42.39 89.51 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.645 179.184 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 9.0 tt -63.8 -24.53 67.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.063 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.486 ' HG3' ' O ' ' A' ' 56' ' ' LEU . 17.4 mt-10 -105.3 2.89 29.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.338 -178.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.554 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 43.6 m -122.66 78.24 47.66 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.675 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.438 ' O ' ' HB2' ' A' ' 66' ' ' ARG . 18.7 Cg_endo -57.84 -34.94 98.94 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.339 2.026 . . . . 0.0 112.099 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -78.39 -46.96 18.63 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.728 -179.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.519 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 12.8 m -72.91 -53.39 11.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.648 -177.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.711 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 0.1 OUTLIER -57.82 -58.9 6.34 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.264 -178.387 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -50.94 -36.24 37.61 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.859 -0.337 . . . . 0.0 111.102 -178.246 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.4 m -69.39 -36.25 76.58 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.071 0.462 . . . . 0.0 110.292 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.435 ' HG3' HD23 ' B' ' 6' ' ' LEU . 5.5 ttpt -65.77 -56.26 12.89 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.263 178.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.737 HG13 HG12 ' A' ' 32' ' ' ILE . 30.2 t -64.85 -21.23 28.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.36 178.537 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.415 ' HB2' ' O ' ' A' ' 66' ' ' ARG . 13.7 t70 -53.45 -48.03 69.18 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 177.295 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.83 -32.92 72.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.767 176.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.762 ' HA ' HG11 ' A' ' 75' ' ' VAL . . . -55.69 -42.44 75.2 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.163 177.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.642 ' HA ' HD12 ' A' ' 43' ' ' ILE . 24.4 t -60.82 -31.65 50.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 176.647 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.46 -36.41 65.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.604 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.762 HG11 ' HA ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -57.73 -28.22 31.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.895 0.379 . . . . 0.0 110.092 179.79 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.747 HD22 HG12 ' A' ' 43' ' ' ILE . 3.0 mm? -71.62 -54.31 10.83 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.534 178.358 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -51.12 -34.63 31.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.439 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.491 ' O ' ' HB2' ' A' ' 82' ' ' LYS . . . -81.5 -30.91 33.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.828 178.479 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 12.5 t-160 -64.58 -30.68 71.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.083 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.488 ' O ' ' HB3' ' A' ' 84' ' ' ALA . 0.7 OUTLIER -83.93 -40.51 18.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.759 -179.346 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -78.78 -54.8 5.71 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -177.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 78' ' ' ALA . 8.0 mmtt -59.46 -31.3 69.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.697 -178.07 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -81.27 -46.16 15.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.979 -179.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.528 ' HA ' ' HG3' ' A' ' 87' ' ' LYS . . . -80.16 8.29 7.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.117 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -73.06 -50.01 25.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.062 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -76.43 -15.16 59.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.957 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.528 ' HG3' ' HA ' ' A' ' 84' ' ' ALA . 0.1 OUTLIER -83.31 -167.76 1.82 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.988 179.931 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.91 83.64 0.94 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.161 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.462 HG21 ' H ' ' A' ' 91' ' ' SER . 13.8 p -83.35 144.77 9.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.012 179.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.42 ' N ' HG21 ' A' ' 89' ' ' VAL . 0.8 OUTLIER -84.06 11.4 8.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.132 -179.626 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.462 ' H ' HG21 ' A' ' 89' ' ' VAL . 7.9 t -83.93 135.96 34.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.015 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.91 109.61 12.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.966 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.81 144.95 32.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.003 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.468 ' O ' ' HD3' ' A' ' 96' ' ' PRO . . . -91.44 -59.67 1.35 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.484 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 1.1 m -108.02 94.15 12.27 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.649 0.262 . . . . 0.0 111.141 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.468 ' HD3' ' O ' ' A' ' 94' ' ' GLY . 37.2 Cg_exo -57.81 120.51 8.47 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.558 2.172 . . . . 0.0 112.256 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 81.5 p -84.65 1.9 44.11 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.865 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.427 ' H ' HG23 ' A' ' 98' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.931 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 7.2 p . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.722 0.296 . . . . 0.0 111.092 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 5.6 m -80.86 135.93 24.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.899 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . 0.458 ' H ' ' HG2' ' B' ' 3' ' ' LYS . 0.0 OUTLIER -94.24 81.99 4.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.966 -179.797 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.67 161.62 16.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.653 179.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -104.32 -66.7 0.94 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.078 -179.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.816 ' HB2' HD12 ' A' ' 47' ' ' LEU . 16.6 mt -64.85 -87.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.774 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . 0.562 HD21 ' H ' ' B' ' 9' ' ' ASN . 0.5 OUTLIER -74.46 124.97 90.19 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.708 179.212 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -79.07 3.82 7.08 Favored 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.18 1.92 . . . . 0.0 112.111 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' ASN . . . . . 0.562 ' H ' HD21 ' B' ' 7' ' ' ASN . 32.8 m-80 -123.53 44.5 2.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.902 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.57 98.13 0.06 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.494 179.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.482 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.1 OUTLIER -122.24 -179.51 4.2 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.634 178.848 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -68.46 172.29 6.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.82 179.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' PHE . . . . . 0.565 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.1 t80 -101.03 107.33 18.75 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.974 0.416 . . . . 0.0 110.93 179.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 1.1 m -111.6 92.07 15.99 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.384 178.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' PRO . . . . . 0.827 ' HB3' ' HA ' ' A' ' 22' ' ' GLN . 53.1 Cg_exo -55.42 -172.83 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.735 2.29 . . . . 0.0 112.775 -178.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . 0.418 ' O ' ' HE3' ' A' ' 21' ' ' LYS . . . 85.0 -43.16 3.22 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.412 -179.514 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -115.77 142.31 29.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.745 0.307 . . . . 0.0 110.931 179.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.626 ' HG2' HE22 ' A' ' 20' ' ' GLN . 9.1 mttt -67.19 98.99 0.64 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.788 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.514 ' HD2' ' HB3' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -73.36 118.68 16.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.902 179.906 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 87.62 28.35 24.51 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.518 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 24.0 t30 -89.24 69.85 8.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.792 0.329 . . . . 0.0 110.849 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 2.8 tp . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.286 -0.864 . . . . 0.0 111.127 -179.877 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.112 0 CA-C-O 120.143 -0.254 . . . . 0.0 112.561 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -77.03 -175.61 2.75 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.588 2.192 . . . . 0.0 112.253 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -91.77 81.2 5.23 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.877 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -101.43 94.42 1.24 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.484 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.0 t -95.06 132.85 27.26 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 120.648 0.261 . . . . 0.0 110.838 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.05 -154.95 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.549 2.166 . . . . 0.0 112.224 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -92.67 -173.62 3.4 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.662 179.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.791 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 3.6 t -87.93 -31.31 19.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.273 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.414 ' N ' HG23 ' A' ' 8' ' ' THR . . . -59.37 -35.43 73.9 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 176.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.7 t -71.08 -36.19 72.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.623 177.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.791 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.3 mtm -64.23 -34.4 78.01 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.896 177.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.631 HD13 ' SD ' ' A' ' 23' ' ' MET . 1.2 mp -52.74 -52.61 55.68 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.843 178.351 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.02 -26.99 67.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.915 178.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.7 p -101.5 21.23 14.61 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.74 -178.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.777 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -134.09 55.92 17.14 Favored Pre-proline 0 CA--C 1.534 0.358 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.208 179.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.54 ' HD3' ' N ' ' A' ' 15' ' ' ALA . 52.2 Cg_exo -57.81 -49.67 12.47 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 122.658 2.239 . . . . 0.0 114.095 -178.341 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.434 ' HD2' ' N ' ' A' ' 16' ' ' PRO . 53.1 Cg_endo -69.11 -157.34 0.04 OUTLIER 'Trans proline' 0 C--N 1.355 0.913 0 C-N-CA 121.928 1.752 . . . . 0.0 112.765 -178.377 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -74.64 47.44 0.32 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.401 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.777 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 1.7 tp10 -86.05 15.7 4.84 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.373 179.53 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.436 HE22 ' HG2' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -51.53 -68.29 0.18 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.628 -179.082 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.545 ' HE2' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.4 -18.49 6.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.371 -178.066 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.638 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 5.4 tp60 -73.6 -79.82 0.08 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.901 0.381 . . . . 0.0 111.336 178.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.68 ' HA ' ' HE2' ' A' ' 11' ' ' MET . 0.0 OUTLIER -69.57 -96.09 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 N-CA-C 112.616 0.599 . . . . 0.0 112.616 -177.08 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.67 HD13 HH11 ' A' ' 27' ' ' ARG . 0.3 OUTLIER -61.04 0.43 0.23 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.059 0.762 . . . . 0.0 113.059 -176.064 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.6 ' O ' HD22 ' A' ' 24' ' ' LEU . . . 64.4 -118.12 12.1 Favored Glycine 0 N--CA 1.446 -0.655 0 N-CA-C 108.332 -1.907 . . . . 0.0 108.332 -175.011 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.491 ' HG3' HD22 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -75.98 -67.65 0.66 Allowed 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 168.71 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.742 ' HG3' HD22 ' A' ' 31' ' ' LEU . 5.2 tpt180 -160.16 12.0 0.12 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.385 -1.28 . . . . 0.0 108.442 175.373 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.667 ' HA ' HD13 ' A' ' 31' ' ' LEU . 4.2 mm? -57.82 -80.44 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.846 -1.07 . . . . 0.0 113.713 -174.16 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.644 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -33.46 -50.16 0.74 Allowed Pre-proline 0 CA--C 1.537 0.446 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -175.223 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.59 ' HG2' ' O ' ' A' ' 27' ' ' ARG . 12.7 Cg_endo -59.16 -42.15 53.4 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.204 1.936 . . . . 0.0 113.521 -177.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.742 HD22 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.09 -45.76 63.08 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 120.144 -0.622 . . . . 0.0 110.151 -179.147 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.63 HD12 ' HB ' ' A' ' 43' ' ' ILE . 0.3 OUTLIER -74.7 -12.36 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.998 178.142 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.637 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 60.3 tp60 -62.13 -39.29 92.08 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 176.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.0 -31.66 71.52 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.298 -0.864 . . . . 0.0 109.076 174.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.51 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 7.1 mtt -100.54 28.13 5.31 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.225 178.014 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.637 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.2 OUTLIER -64.09 -31.95 6.88 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 -177.267 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.536 ' CD ' ' N ' ' A' ' 36' ' ' HIS . 63.0 Cg_exo -37.68 -30.51 0.14 Allowed 'Trans proline' 0 C--N 1.361 1.236 0 C-N-CA 122.047 1.831 . . . . 0.0 112.159 179.055 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.811 HG23 HG12 ' A' ' 73' ' ' VAL . 0.2 OUTLIER -78.16 -89.11 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.737 176.578 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.509 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.1 OUTLIER -171.24 58.4 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.92 177.718 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.486 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -43.47 -35.4 1.61 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.743 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.644 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.16 -57.42 8.02 Favored Glycine 0 C--O 1.229 -0.216 0 CA-C-N 115.961 -0.563 . . . . 0.0 114.098 -178.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.608 ' HG3' ' HE3' ' A' ' 46' ' ' MET . 1.6 tptm -79.03 -39.01 35.11 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 117.085 0.442 . . . . 0.0 112.15 -178.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.63 ' HB ' HD12 ' A' ' 32' ' ' ILE . 17.2 mt -53.09 -48.62 53.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 C-N-CA 121.155 -0.218 . . . . 0.0 111.426 -177.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.506 HG23 ' O ' ' A' ' 41' ' ' GLY . 5.1 t -47.86 -48.04 31.33 Favored 'General case' 0 CA--C 1.521 -0.17 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 178.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.554 ' CA ' ' HB2' ' B' ' 13' ' ' PHE . . . -56.67 -53.25 45.17 Favored Glycine 0 N--CA 1.449 -0.458 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.871 179.212 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.608 ' HE3' ' HG3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.33 -56.43 20.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.794 0.33 . . . . 0.0 110.982 -179.112 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.707 HD12 ' HB2' ' B' ' 7' ' ' ASN . 2.9 mm? -80.28 7.76 8.83 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.397 -179.247 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.477 HD23 ' O ' ' A' ' 44' ' ' THR . 0.0 OUTLIER -65.46 -20.9 66.55 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.791 0.329 . . . . 0.0 110.748 179.897 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.484 ' HG3' ' O ' ' B' ' 9' ' ' ASN . 3.6 mt-10 -75.71 20.27 0.18 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.888 179.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.491 HD13 ' HE3' ' A' ' 68' ' ' LYS . 2.7 tt -83.58 169.07 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.905 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.439 ' HB2' ' HG3' ' A' ' 54' ' ' GLU . 2.6 m-20 -71.03 155.93 40.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.951 0.405 . . . . 0.0 111.427 -179.626 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.486 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 4.2 m120 -88.06 -28.46 21.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.643 177.238 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.96 -30.67 62.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.608 177.125 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.578 ' O ' ' HG2' ' A' ' 58' ' ' MET . 4.0 mt-10 -77.26 -29.41 53.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.49 178.776 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.497 ' CD1' ' HB2' ' A' ' 27' ' ' ARG . 0.6 OUTLIER -58.79 -46.1 88.36 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.209 -179.901 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.405 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 7.6 tp -60.75 -47.38 86.56 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.558 178.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -65.72 -20.07 66.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.375 -179.644 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.636 ' SD ' ' HA ' ' A' ' 65' ' ' LEU . 25.3 mmt -69.65 -54.57 13.28 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.054 -179.708 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.589 HD21 ' NE ' ' A' ' 27' ' ' ARG . 0.1 OUTLIER -63.27 -17.87 62.96 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.893 0.377 . . . . 0.0 110.685 179.479 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.481 ' O ' ' HG3' ' A' ' 60' ' ' GLU . 0.0 OUTLIER -94.73 -13.26 25.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.788 -179.856 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.587 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.5 OUTLIER -122.3 87.66 48.44 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.189 -179.872 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -59.31 -32.22 96.41 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.268 1.979 . . . . 0.0 112.129 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -77.78 -49.77 13.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.618 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.421 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 75.5 m -69.16 -46.34 67.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.185 -178.469 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.636 ' HA ' ' SD ' ' A' ' 58' ' ' MET . 1.2 tp -60.17 -64.74 0.84 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.814 -178.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.559 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -49.54 -28.83 5.98 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.875 -177.933 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.469 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 9.2 t -62.32 -45.32 93.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.181 177.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.534 ' HG2' HD11 ' B' ' 6' ' ' LEU . 14.2 mtmm -66.45 -62.05 1.67 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.921 179.355 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.704 ' HA ' ' HB3' ' A' ' 72' ' ' ALA . 73.2 t -57.75 -20.72 14.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.756 -179.321 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.469 ' HB3' ' O ' ' A' ' 67' ' ' SER . 10.0 t70 -57.26 -49.22 76.74 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 175.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -67.18 -27.76 67.54 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.547 175.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.704 ' HB3' ' HA ' ' A' ' 69' ' ' VAL . . . -66.1 -36.68 83.83 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.586 178.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.811 HG12 HG23 ' A' ' 38' ' ' THR . 5.1 t -59.94 -32.85 50.94 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.184 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 176.23 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.69 -34.18 64.76 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.824 175.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.678 HG21 ' HG ' ' B' ' 4' ' ' SER . 15.7 t -55.03 -33.07 28.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.919 178.205 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.63 ' HB2' HG12 ' A' ' 43' ' ' ILE . 3.1 tm? -71.36 -47.08 58.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.173 177.581 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 32.6 mm-40 -63.87 -24.05 67.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.048 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.8 -24.94 38.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.834 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.564 ' O ' ' HB3' ' A' ' 83' ' ' GLU . 26.1 t-80 -68.48 -41.68 79.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.861 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 66.3 mt-30 -62.86 -14.9 51.71 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.267 -179.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -76.55 -54.55 6.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.138 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.03 -19.51 47.49 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.115 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.564 ' HB3' ' O ' ' A' ' 79' ' ' HIS . 0.2 OUTLIER -75.36 -47.17 28.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.674 179.986 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.418 ' N ' ' HG3' ' A' ' 83' ' ' GLU . . . -65.6 -13.63 59.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.057 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -74.63 -14.61 60.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.98 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -77.34 -55.69 5.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.808 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.15 -72.23 0.43 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.858 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -74.56 93.16 2.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.086 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 4.6 t -92.75 102.47 13.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.047 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.15 76.07 1.7 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.838 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.01 179.86 7.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.966 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.02 90.65 4.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.982 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 19.1 p -97.55 -178.81 4.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.906 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -83.82 81.28 1.76 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.467 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 1.9 t -104.8 113.34 64.99 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 120.632 0.254 . . . . 0.0 111.125 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -60.04 167.87 6.75 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.715 2.277 . . . . 0.0 112.206 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 14.1 p -91.14 145.92 24.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.858 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 1.4 t . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.036 -0.983 . . . . 0.0 111.084 -179.796 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 8.3 p . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 121.217 0.532 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 5.9 p -84.17 134.21 27.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.13 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.31 172.2 8.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.053 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' SER . . . . . 0.678 ' HG ' HG21 ' A' ' 75' ' ' VAL . 4.5 t -83.26 -150.02 0.1 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.601 179.483 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' ASN . . . . . 0.482 ' H ' ' HG ' ' B' ' 4' ' ' SER . 9.1 m120 -103.89 -62.13 1.35 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.65 0.262 . . . . 0.0 110.943 -179.509 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.645 ' HB3' HD13 ' A' ' 47' ' ' LEU . 27.1 tp -71.92 -83.68 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.381 179.318 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . 0.707 ' HB2' HD12 ' A' ' 47' ' ' LEU . 1.9 t30 -82.81 129.15 63.08 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.267 178.151 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 7.1 Cg_exo -73.94 4.25 4.35 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.187 1.924 . . . . 0.0 111.997 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' ASN . . . . . 0.484 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 18.5 m120 -123.63 37.42 4.42 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.308 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . 0.652 ' HB3' ' HB2' ' B' ' 4' ' ' SER . . . -60.43 87.5 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.087 179.263 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.441 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 1.5 mmtp -116.21 177.86 4.53 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.964 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . 0.516 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -68.21 158.76 32.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.72 0.295 . . . . 0.0 111.065 179.76 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' PHE . . . . . 0.554 ' HB2' ' CA ' ' A' ' 45' ' ' GLY . 1.1 t80 -88.86 110.27 20.92 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.857 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . 0.423 ' H ' HG22 ' B' ' 14' ' ' VAL . 1.2 m -111.58 87.64 8.29 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.342 178.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' PRO . . . . . 0.464 ' HD3' ' O ' ' B' ' 13' ' ' PHE . 52.0 Cg_exo -55.72 -166.17 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 122.889 2.393 . . . . 0.0 113.139 -178.49 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.3 -50.86 4.43 Favored Glycine 0 N--CA 1.452 -0.239 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.386 -179.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 10.9 m -116.69 161.8 15.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.728 0.299 . . . . 0.0 111.027 178.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.436 ' HG2' HE22 ' A' ' 20' ' ' GLN . 0.0 OUTLIER -75.95 96.6 3.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.672 179.356 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -65.0 99.28 0.34 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.943 -179.664 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 78.66 71.6 1.23 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.424 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 14.2 p-10 -101.42 131.4 47.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.744 0.307 . . . . 0.0 110.888 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . 0.437 HD12 HG22 ' B' ' 22' ' ' ILE . 23.1 mm . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.189 -0.91 . . . . 0.0 111.065 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.19 0 N-CA-C 112.45 -0.26 . . . . 0.0 112.45 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -57.23 165.99 4.86 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.622 2.215 . . . . 0.0 112.277 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.23 89.29 7.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.79 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -98.03 -27.92 8.54 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.595 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 16.8 t -88.89 110.97 41.68 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 120.549 0.214 . . . . 0.0 110.902 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -68.09 153.61 74.5 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.478 2.119 . . . . 0.0 112.312 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.404 ' O ' ' HG3' ' A' ' 11' ' ' MET . 6.7 mp -86.55 -174.99 5.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.87 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.828 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 12.7 t -87.93 -26.17 22.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.236 179.679 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.61 -41.01 89.41 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 176.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 7.5 t -67.44 -33.79 75.88 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.508 176.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.828 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.1 mtm -64.25 -37.24 86.79 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.182 177.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.81 HD22 ' HB3' ' A' ' 24' ' ' LEU . 22.9 mt -54.28 -45.99 72.62 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.547 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.8 -36.3 82.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.102 178.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -101.16 46.55 0.94 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.047 -179.655 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.673 ' O ' ' HB2' ' A' ' 19' ' ' GLU . . . -133.06 -41.33 0.03 OUTLIER Pre-proline 0 CA--C 1.536 0.437 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 -178.076 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.702 ' HA ' ' O ' ' A' ' 17' ' ' PRO . 70.4 Cg_exo -46.52 154.63 0.9 Allowed 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 121.866 1.71 . . . . 0.0 112.893 -176.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.702 ' O ' ' HA ' ' A' ' 16' ' ' PRO . 14.4 Cg_exo -71.75 -99.45 0.0 OUTLIER 'Cis proline' 0 CA--C 1.539 0.737 0 C-N-CA 124.251 -1.146 . . . . 0.0 114.414 3.225 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.433 ' H ' ' HB2' ' A' ' 17' ' ' PRO . 17.9 mt-30 -74.82 65.68 1.41 Allowed 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 113.307 0.854 . . . . 0.0 113.307 -175.438 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.673 ' HB2' ' O ' ' A' ' 15' ' ' ALA . 1.1 tp10 -105.63 12.94 30.57 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.64 0.257 . . . . 0.0 110.876 176.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.613 HE22 ' HG2' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -47.0 -56.7 5.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.605 -178.853 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.614 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -56.07 -22.34 27.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.648 -178.359 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.614 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 5.4 tp60 -73.46 -79.91 0.08 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.915 0.388 . . . . 0.0 111.677 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.56 ' HE1' ' HA ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.76 -96.22 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -176.47 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.81 ' HB3' HD22 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -59.26 -2.45 0.29 Allowed 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 113.647 0.98 . . . . 0.0 113.647 -175.359 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.596 ' O ' HD22 ' A' ' 24' ' ' LEU . . . 64.48 -116.78 9.45 Favored Glycine 0 N--CA 1.448 -0.549 0 N-CA-C 108.374 -1.891 . . . . 0.0 108.374 -174.621 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.576 ' HG3' HD21 ' A' ' 55' ' ' LEU . 0.8 OUTLIER -76.23 -69.14 0.52 Allowed 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 168.269 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.65 ' NE ' HD13 ' A' ' 59' ' ' LEU . 0.2 OUTLIER -159.82 13.1 0.13 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.163 -1.381 . . . . 0.0 108.178 174.56 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.578 HD12 ' HB2' ' A' ' 47' ' ' LEU . 4.1 mm? -57.64 -78.57 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.662 -1.153 . . . . 0.0 113.439 -174.379 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.602 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -37.42 -48.88 2.47 Favored Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 -174.799 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.576 ' HG3' ' HB2' ' A' ' 24' ' ' LEU . 12.6 Cg_endo -58.69 -43.29 45.82 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 122.14 1.893 . . . . 0.0 113.621 -177.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.577 ' HG ' ' O ' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.19 -46.69 60.74 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 120.111 -0.636 . . . . 0.0 110.289 -178.719 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.562 HG21 HD12 ' A' ' 43' ' ' ILE . 0.4 OUTLIER -73.28 -12.47 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 CA-C-N 116.208 -0.451 . . . . 0.0 109.969 178.224 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.602 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 47.7 tp60 -62.14 -40.54 96.3 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 176.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.62 -29.98 69.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.08 174.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.57 ' SD ' HG11 ' A' ' 69' ' ' VAL . 6.7 mtt -101.65 27.17 6.61 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.394 178.428 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.602 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -63.66 -32.08 7.49 Favored Pre-proline 0 CA--C 1.537 0.445 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -177.594 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.555 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 50.5 Cg_exo -35.97 -32.55 0.1 Allowed 'Trans proline' 0 C--N 1.363 1.342 0 C-N-CA 122.178 1.919 . . . . 0.0 112.034 178.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.798 HG23 HG12 ' A' ' 73' ' ' VAL . 7.2 m -78.14 -88.58 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.512 176.014 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.508 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.3 OUTLIER -171.59 62.73 0.03 OUTLIER 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.196 177.552 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.464 ' HB3' ' HB ' ' A' ' 32' ' ' ILE . . . -46.67 -34.72 5.32 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.662 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.602 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -52.88 -53.94 30.93 Favored Glycine 0 C--N 1.33 0.239 0 C-N-CA 121.17 -0.538 . . . . 0.0 113.81 -178.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.474 ' HD2' ' HG2' ' B' ' 12' ' ' GLU . 0.0 OUTLIER -78.11 -39.0 42.7 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.887 0.343 . . . . 0.0 111.797 -178.387 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.627 HD11 ' HA ' ' A' ' 73' ' ' VAL . 31.8 mt -53.95 -54.14 22.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.038 -179.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.563 HG23 ' CD2' ' A' ' 29' ' ' PHE . 6.4 t -50.17 -45.69 53.58 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 120.889 0.376 . . . . 0.0 110.121 178.003 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.542 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -50.83 -67.46 1.92 Allowed Glycine 0 N--CA 1.451 -0.317 0 CA-C-N 115.606 -0.724 . . . . 0.0 113.235 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.547 ' HE3' HG22 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -56.05 -46.06 79.05 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 -178.031 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.578 ' HB2' HD12 ' A' ' 28' ' ' LEU . 3.3 mm? -80.11 3.09 21.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.719 -0.219 . . . . 0.0 111.588 -178.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.55 ' HG ' ' CE1' ' B' ' 13' ' ' PHE . 0.0 OUTLIER -65.96 -8.24 21.51 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.938 0.399 . . . . 0.0 110.54 179.253 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.449 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 1.4 mm-40 -83.47 18.36 1.87 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.373 178.433 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 1.5 tt -83.27 163.85 2.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.96 -179.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.422 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 3.4 m-20 -70.81 157.56 37.88 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.564 -179.124 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.679 ' HA ' HD21 ' A' ' 55' ' ' LEU . 4.6 m120 -86.61 -28.83 23.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.969 177.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 8.7 m -73.9 -32.09 63.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.644 177.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -75.98 -29.5 58.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.554 178.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.679 HD21 ' HA ' ' A' ' 52' ' ' ASN . 0.5 OUTLIER -59.45 -47.74 84.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.504 -179.766 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.438 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 52.4 tp -61.7 -40.72 96.02 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.712 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -66.02 -30.95 71.58 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.164 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.48 -54.85 22.38 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.897 -179.601 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.65 HD13 ' NE ' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -66.1 -13.08 59.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.115 0.483 . . . . 0.0 110.123 178.76 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.508 ' O ' ' HG3' ' A' ' 60' ' ' GLU . 2.3 tp10 -95.46 -12.92 25.07 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.631 177.537 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.539 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 4.1 m -122.57 79.58 47.21 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.732 179.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -54.58 -34.21 81.87 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.398 2.065 . . . . 0.0 112.206 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -77.95 -49.72 13.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.552 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.439 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 3.7 m -71.23 -23.12 61.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.904 0.383 . . . . 0.0 111.4 -178.607 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.539 ' HB3' ' O ' ' A' ' 61' ' ' SER . 1.7 tp -78.54 -64.87 1.07 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.639 -178.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.539 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 1.5 ttm180 -51.43 -29.27 15.41 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.849 -178.104 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.544 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 3.3 t -69.67 -40.84 76.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.301 0.572 . . . . 0.0 110.005 177.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.402 ' O ' HD13 ' B' ' 6' ' ' LEU . 21.4 ttpt -65.74 -59.69 3.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.203 178.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.714 ' HA ' ' HB3' ' A' ' 72' ' ' ALA . 54.1 t -62.47 -19.89 23.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.637 179.222 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.544 ' HB3' ' O ' ' A' ' 67' ' ' SER . 17.1 t70 -54.07 -48.99 70.05 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 176.531 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -66.77 -32.9 74.5 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.658 176.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.714 ' HB3' ' HA ' ' A' ' 69' ' ' VAL . . . -58.19 -38.11 76.09 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.525 178.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.798 HG12 HG23 ' A' ' 38' ' ' THR . 8.0 t -65.26 -31.4 53.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.61 177.421 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.1 -37.08 69.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.146 179.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.562 HG11 ' HB2' ' B' ' 5' ' ' ASN . 0.9 OUTLIER -57.61 -31.71 40.2 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.115 0 CA-C-O 121.168 0.508 . . . . 0.0 109.955 178.989 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.498 ' N ' HG23 ' A' ' 75' ' ' VAL . 2.8 tm? -71.24 -49.91 38.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.39 179.061 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -54.94 -37.33 66.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.664 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.15 -24.28 37.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.811 179.133 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.47 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 6.6 t60 -66.1 -53.84 33.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.816 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -66.13 -15.37 63.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.042 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -63.5 -66.59 0.52 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.912 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.68 -11.9 60.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.775 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.47 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 0.2 OUTLIER -83.66 -25.63 30.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.846 179.757 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.22 -24.94 67.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.04 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.41 -46.99 80.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.987 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 4.9 mm100 -81.41 -161.68 0.44 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.811 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.411 ' H ' ' HG3' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -75.94 101.4 5.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.823 -179.937 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -84.03 65.49 8.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.926 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -97.44 173.43 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.03 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -91.66 -57.35 2.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.958 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.46 109.1 12.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.955 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -87.93 -63.56 1.28 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.055 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 22.4 p -111.18 -177.64 3.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.888 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -101.71 89.66 0.78 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.524 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.0 m -95.81 141.44 23.18 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 120.633 0.254 . . . . 0.0 111.051 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -58.29 -71.24 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.618 2.212 . . . . 0.0 112.409 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.4 m -107.11 -65.03 1.13 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.97 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 16.7 m . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.071 -0.966 . . . . 0.0 111.03 -179.959 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . 0.419 ' H3 ' ' H ' ' B' ' 2' ' ' VAL . 1.5 t . . . . . 0 N--CA 1.487 1.417 0 CA-C-O 120.886 0.374 . . . . 0.0 110.859 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . 0.419 ' H ' ' H3 ' ' B' ' 1' ' ' VAL . 19.2 t -81.39 138.69 19.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.999 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 4.9 mtpm? -91.84 85.32 5.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.061 -179.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' SER . . . . . 0.466 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -76.36 179.79 5.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.769 179.838 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' ASN . . . . . 0.562 ' HB2' HG11 ' A' ' 75' ' ' VAL . 0.4 OUTLIER -104.01 -77.12 0.58 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.881 -179.549 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.402 HD13 ' O ' ' A' ' 68' ' ' LYS . 5.6 mt -62.81 -85.32 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.808 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . 0.433 ' HA ' ' HD3' ' B' ' 8' ' ' PRO . 2.7 t30 -75.85 130.05 79.63 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.866 179.538 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 6.6 Cg_exo -73.28 -3.41 13.63 Favored 'Trans proline' 0 N--CA 1.46 -0.475 0 C-N-CA 122.368 2.045 . . . . 0.0 111.625 178.654 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' ASN . . . . . 0.666 ' HB3' ' HZ3' ' B' ' 11' ' ' LYS . 7.9 m120 -123.48 51.97 1.45 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.636 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . 0.466 ' HB1' ' HB3' ' B' ' 4' ' ' SER . . . -59.86 95.67 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.756 -179.156 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.666 ' HZ3' ' HB3' ' B' ' 9' ' ' ASN . 9.6 mttp -121.57 121.69 37.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.027 178.072 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . 0.474 ' HG2' ' HD2' ' A' ' 42' ' ' LYS . 6.0 mt-10 -49.68 176.87 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.315 0.579 . . . . 0.0 112.366 -177.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' PHE . . . . . 0.55 ' CE1' ' HG ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -87.24 97.08 10.57 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.248 179.952 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . 0.602 ' HB ' ' HD3' ' B' ' 15' ' ' PRO . 2.8 t -129.29 -53.98 0.03 OUTLIER Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.489 -178.082 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' PRO . . . . . 0.602 ' HD3' ' HB ' ' B' ' 14' ' ' VAL . 85.9 Cg_exo -47.73 -36.39 25.66 Favored 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 122.311 2.007 . . . . 0.0 112.806 -178.702 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . 0.543 ' O ' ' HB2' ' A' ' 21' ' ' LYS . . . 75.98 -8.84 20.79 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.475 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 4.6 m -104.81 -172.33 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 N-CA-C 110.518 -0.179 . . . . 0.0 110.518 179.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.613 ' HG2' HE22 ' A' ' 20' ' ' GLN . 9.0 mttt -59.8 90.68 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.925 0.393 . . . . 0.0 110.625 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.436 ' HB3' ' O ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -81.11 132.12 35.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.0 -179.222 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 92.99 -55.53 2.55 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.489 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -101.91 169.91 8.48 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.873 0.368 . . . . 0.0 110.955 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.19 -0.91 . . . . 0.0 111.052 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.31 0 N-CA-C 112.515 -0.234 . . . . 0.0 112.515 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.68 123.28 9.97 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.516 2.144 . . . . 0.0 112.217 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 mp -91.71 155.06 18.56 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.972 -179.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -89.26 26.07 9.5 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.467 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.538 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 23.6 t -77.51 -50.92 1.98 Allowed Pre-proline 0 C--N 1.329 -0.29 0 N-CA-C 111.36 0.133 . . . . 0.0 111.36 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.538 ' HD2' ' N ' ' A' ' 5' ' ' SER . 39.9 Cg_endo -66.4 108.6 1.41 Allowed 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 122.108 1.872 . . . . 0.0 111.975 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.457 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.5 OUTLIER -93.92 -48.42 6.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.244 -179.238 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.719 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 3.0 t -87.85 -34.79 18.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.717 -178.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.441 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.18 -36.1 74.74 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 177.406 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.8 t -70.21 -34.81 73.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.729 177.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.719 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 4.1 mtm -64.36 -35.34 80.56 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.823 177.633 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.775 HD12 ' HB3' ' A' ' 24' ' ' LEU . 3.8 mp -52.47 -51.21 60.49 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.994 178.769 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.96 -26.92 67.79 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.778 178.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.7 15.85 27.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.688 -178.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.578 ' HB3' ' HB3' ' A' ' 19' ' ' GLU . . . -134.51 56.14 16.98 Favored Pre-proline 0 CA--C 1.534 0.335 0 CA-C-O 120.546 0.212 . . . . 0.0 111.272 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.529 ' HD3' ' N ' ' A' ' 15' ' ' ALA . 48.4 Cg_exo -57.42 -49.69 12.98 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.68 2.253 . . . . 0.0 113.938 -178.592 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.488 ' HD3' ' HB2' ' A' ' 16' ' ' PRO . 22.9 Cg_exo -65.33 -161.04 0.04 OUTLIER 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 122.145 1.896 . . . . 0.0 112.501 -178.742 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -73.76 66.05 1.07 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.635 179.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.578 ' HB3' ' HB3' ' A' ' 15' ' ' ALA . 1.3 tp10 -104.6 9.65 35.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.782 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.535 HE22 ' HG2' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -47.72 -62.17 1.58 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.424 -178.423 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.829 ' HE3' ' HA ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER -55.73 -20.92 16.3 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.895 -177.049 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.635 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 23.5 tt0 -73.81 -80.3 0.08 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.013 0.435 . . . . 0.0 111.683 179.309 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.604 ' HA ' ' HE3' ' A' ' 11' ' ' MET . 0.0 OUTLIER -70.16 -96.84 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.04 0.755 . . . . 0.0 113.04 -176.453 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.775 ' HB3' HD12 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -57.69 0.83 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -175.422 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.502 ' O ' HD23 ' A' ' 24' ' ' LEU . . . 64.86 -118.06 11.63 Favored Glycine 0 N--CA 1.446 -0.681 0 N-CA-C 108.349 -1.901 . . . . 0.0 108.349 -174.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.482 ' HG3' ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -76.07 -67.31 0.69 Allowed 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 168.713 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.843 ' HG3' HD23 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -160.09 8.12 0.1 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.262 -1.335 . . . . 0.0 108.142 175.278 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.787 HD23 ' HA ' ' A' ' 44' ' ' THR . 0.3 OUTLIER -59.28 -78.21 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.305 -1.316 . . . . 0.0 113.942 -173.656 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.62 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -33.67 -48.88 0.75 Allowed Pre-proline 0 CA--C 1.535 0.397 0 N-CA-C 113.758 1.022 . . . . 0.0 113.758 -175.147 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.604 ' HG3' ' HB2' ' A' ' 24' ' ' LEU . 18.9 Cg_endo -61.01 -42.86 33.63 Favored 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 122.137 1.891 . . . . 0.0 113.291 -178.052 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.843 HD23 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.36 -44.9 64.13 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 119.956 -0.698 . . . . 0.0 110.153 -179.566 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.63 HG12 HG12 ' A' ' 69' ' ' VAL . 0.5 OUTLIER -73.05 -14.46 16.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 CA-C-N 116.233 -0.44 . . . . 0.0 109.891 178.018 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.643 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 4.4 tp-100 -62.41 -38.69 90.64 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 176.489 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.42 -30.12 69.79 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.327 -0.851 . . . . 0.0 108.939 174.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.616 ' SD ' HG11 ' A' ' 69' ' ' VAL . 6.8 mtt -102.18 26.28 7.87 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.209 177.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.643 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.9 p-80 -64.59 -32.08 6.57 Favored Pre-proline 0 CA--C 1.536 0.41 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 -177.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.562 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 44.4 Cg_exo -35.1 -34.06 0.1 OUTLIER 'Trans proline' 0 C--N 1.363 1.317 0 C-N-CA 122.24 1.96 . . . . 0.0 112.319 178.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 52.6 m -78.52 -87.61 0.06 Allowed 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.678 176.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.555 ' HB2' HD13 ' A' ' 76' ' ' LEU . 0.1 OUTLIER -171.47 63.78 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.49 178.102 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.487 ' HB1' ' O ' ' A' ' 32' ' ' ILE . . . -47.96 -34.69 9.56 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 120.873 0.368 . . . . 0.0 111.622 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.62 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -51.5 -56.93 13.16 Favored Glycine 0 CA--C 1.518 0.23 0 CA-C-N 115.948 -0.569 . . . . 0.0 114.034 -178.379 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.59 ' HE2' ' SD ' ' A' ' 46' ' ' MET . 2.5 tptm -75.6 -35.65 60.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 117.034 0.417 . . . . 0.0 111.686 -177.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.755 HD11 ' HA ' ' A' ' 73' ' ' VAL . 41.2 mt -54.02 -59.48 2.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.139 -179.37 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.787 ' HA ' HD23 ' A' ' 28' ' ' LEU . 11.0 t -47.82 -43.12 27.71 Favored 'General case' 0 CA--C 1.522 -0.129 0 CA-C-O 120.85 0.357 . . . . 0.0 110.444 178.863 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.685 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -48.23 -71.79 0.53 Allowed Glycine 0 N--CA 1.45 -0.396 0 CA-C-N 115.738 -0.665 . . . . 0.0 113.232 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.59 ' SD ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.7 -43.41 76.44 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 117.035 0.417 . . . . 0.0 111.723 -178.399 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.651 HD11 ' HB3' ' B' ' 6' ' ' LEU . 3.1 mm? -79.84 5.64 13.15 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.682 0.253 . . . . 0.0 111.682 -178.517 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.62 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.17 -12.02 53.23 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.868 0.366 . . . . 0.0 110.605 179.627 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.43 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.1 mm-40 -78.0 17.65 0.57 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.364 177.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.442 ' H ' ' C ' ' A' ' 48' ' ' LEU . 0.9 OUTLIER -83.45 159.46 3.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.1 -179.398 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.599 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 3.9 m-20 -71.01 151.1 44.96 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -178.064 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.503 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 2.2 t-20 -80.52 -30.51 37.19 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.679 177.016 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 39.6 m -73.99 -31.87 63.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.662 177.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.599 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 0.9 OUTLIER -76.55 -27.87 56.08 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.536 178.746 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.532 ' CD1' ' HB2' ' A' ' 27' ' ' ARG . 0.6 OUTLIER -59.39 -48.73 80.51 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.355 179.841 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.483 ' HA ' HD22 ' A' ' 56' ' ' LEU . 0.9 OUTLIER -60.7 -43.61 97.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.551 179.614 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -59.59 -32.57 70.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.22 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.471 ' HE1' ' HE2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -65.94 -45.41 81.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.324 -179.408 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.592 HD22 ' NE ' ' A' ' 27' ' ' ARG . 0.2 OUTLIER -67.15 -16.19 64.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.261 -179.524 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -98.79 -11.13 22.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.869 0.366 . . . . 0.0 110.915 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.579 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -123.68 86.48 52.85 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.864 179.859 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -60.35 -33.37 94.41 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.368 2.045 . . . . 0.0 112.216 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.603 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -77.98 -44.99 25.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.193 -179.723 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.603 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 14.5 m -73.83 -25.97 60.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.934 0.397 . . . . 0.0 111.051 -179.521 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.605 HD12 HD22 ' A' ' 31' ' ' LEU . 1.9 tp -78.76 -65.69 0.96 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.621 -178.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.575 ' HE ' ' HE3' ' A' ' 35' ' ' MET . 0.1 OUTLIER -51.4 -28.09 11.79 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.973 -178.0 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.561 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 28.7 t -69.42 -42.68 74.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.149 0.499 . . . . 0.0 110.094 178.129 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.505 ' O ' HD23 ' B' ' 6' ' ' LEU . 2.5 ttmm -66.08 -57.22 8.2 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.55 179.278 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.712 ' HA ' ' HB2' ' A' ' 72' ' ' ALA . 52.9 t -64.11 -18.73 23.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.636 179.289 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.582 ' O ' HG23 ' A' ' 73' ' ' VAL . 21.9 t70 -55.65 -49.95 71.52 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 176.552 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -68.53 -24.94 64.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.771 177.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.712 ' HB2' ' HA ' ' A' ' 69' ' ' VAL . . . -63.26 -50.58 69.62 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.191 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.755 ' HA ' HD11 ' A' ' 43' ' ' ILE . 3.7 m -58.15 -29.19 36.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 178.178 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.09 -36.75 75.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.083 179.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.68 HG11 ' HA ' ' A' ' 72' ' ' ALA . 1.3 m -59.67 -31.92 48.16 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.123 0 CA-C-O 121.078 0.466 . . . . 0.0 110.016 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.602 ' N ' HG23 ' A' ' 75' ' ' VAL . 2.4 tm? -71.91 -49.85 34.29 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.317 178.228 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 48.0 mm-40 -54.44 -39.82 67.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.51 179.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.48 -19.62 41.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.095 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.549 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 4.0 t60 -63.09 -55.92 21.28 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.016 -179.398 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -74.99 -10.26 59.31 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.961 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.42 -64.26 1.23 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.238 -179.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.75 -17.7 64.8 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.196 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.549 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 0.8 OUTLIER -74.51 -49.01 23.73 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.952 179.89 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -79.4 -8.94 59.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.942 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -79.71 -38.61 33.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.075 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -76.17 -169.5 1.17 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.822 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.82 -21.39 59.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.99 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -81.51 80.69 7.82 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.039 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.438 ' H ' HG21 ' A' ' 89' ' ' VAL . 0.0 OUTLIER -95.52 19.82 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.862 179.835 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -90.39 128.32 36.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.939 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 5.5 m -80.37 -73.29 0.37 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.016 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -92.01 -174.66 3.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.053 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 13.5 p -108.73 -6.16 16.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.986 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -101.16 -45.92 1.79 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.558 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 10.6 t -103.78 107.31 56.16 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-O 120.622 0.249 . . . . 0.0 111.101 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -70.08 -160.26 0.07 OUTLIER 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.556 2.171 . . . . 0.0 112.331 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.98 -172.09 3.93 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.938 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 21.7 t . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.059 -0.972 . . . . 0.0 111.055 179.967 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.795 0.331 . . . . 0.0 111.077 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . 0.447 HG21 ' N ' ' B' ' 3' ' ' LYS . 8.7 p -79.56 142.26 14.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.089 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . 0.447 ' N ' HG21 ' B' ' 2' ' ' VAL . 0.1 OUTLIER -95.76 90.48 5.67 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.03 -179.842 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' SER . . . . . 0.47 ' HB2' ' O ' ' B' ' 7' ' ' ASN . 0.0 OUTLIER -87.78 173.25 9.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.736 179.683 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -104.17 -72.23 0.71 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.291 -179.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.651 ' HB3' HD11 ' A' ' 47' ' ' LEU . 6.0 tp -62.43 -82.44 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.612 -179.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . 0.503 ' HB2' ' CD1' ' A' ' 47' ' ' LEU . 2.3 t30 -75.22 136.46 72.42 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.651 178.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.72 -10.72 18.49 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 122.117 1.878 . . . . 0.0 111.819 178.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' ASN . . . . . 0.517 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 4.0 m120 -123.93 63.25 1.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.769 179.777 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . 0.421 ' HB3' ' HB3' ' A' ' 46' ' ' MET . . . -60.15 92.06 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.561 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.517 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.2 OUTLIER -118.66 123.64 45.43 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.284 178.592 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . 0.556 ' HG2' ' HZ2' ' A' ' 42' ' ' LYS . 8.5 mt-10 -47.97 172.14 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.251 0.548 . . . . 0.0 112.366 -178.149 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' PHE . . . . . 0.685 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.5 OUTLIER -87.42 79.94 8.27 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.799 179.088 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . 0.824 ' H ' ' HD2' ' B' ' 15' ' ' PRO . 1.2 m -113.42 -45.14 0.07 OUTLIER Pre-proline 0 CA--C 1.538 0.484 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -176.729 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' PRO . . . . . 0.824 ' HD2' ' H ' ' B' ' 14' ' ' VAL . 3.8 Cg_endo -46.75 -39.56 23.9 Favored 'Trans proline' 0 C--N 1.355 0.909 0 C-N-CA 122.425 2.083 . . . . 0.0 112.543 -178.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.68 -29.05 2.36 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.547 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.829 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.2 OUTLIER -94.92 -171.92 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 120.538 0.209 . . . . 0.0 110.689 179.77 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.535 ' HG2' HE22 ' A' ' 20' ' ' GLN . 4.3 mtmp? -60.01 93.79 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.879 0.371 . . . . 0.0 110.985 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -85.88 100.54 12.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.049 -179.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 91.54 76.65 1.33 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.458 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -95.5 13.31 26.46 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.785 0.326 . . . . 0.0 111.071 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.26 -0.876 . . . . 0.0 111.015 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.199 0 N-CA-C 112.41 -0.276 . . . . 0.0 112.41 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -70.97 112.88 3.4 Favored 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.586 2.191 . . . . 0.0 112.199 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.2 mp -91.63 164.11 13.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.904 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -103.61 112.27 4.15 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.783 -0.723 . . . . 0.0 112.55 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 56.9 p -76.52 137.59 67.33 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-O 120.529 0.204 . . . . 0.0 110.964 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.408 ' HG2' ' HB2' ' A' ' 10' ' ' SER . 41.5 Cg_endo -67.13 129.98 21.75 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.495 2.13 . . . . 0.0 112.185 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.441 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.8 OUTLIER -87.31 -74.73 0.43 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.052 -179.695 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.735 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 4.8 t -87.94 -28.84 21.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.552 -179.395 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.635 ' HB3' HE22 ' A' ' 33' ' ' GLN . . . -59.45 -39.02 82.26 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 177.167 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.408 ' HB2' ' HG2' ' A' ' 6' ' ' PRO . 0.5 OUTLIER -70.14 -34.83 73.54 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.651 177.221 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.735 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 3.2 mtm -64.46 -34.78 78.99 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.765 177.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.594 HD22 HH12 ' A' ' 27' ' ' ARG . 1.9 mp -52.58 -52.18 56.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.111 178.631 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.88 -26.25 67.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.781 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -101.83 15.78 27.93 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.699 -179.005 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.715 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -134.11 55.78 16.54 Favored Pre-proline 0 CA--C 1.532 0.276 0 CA-C-N 116.71 -0.223 . . . . 0.0 111.446 -179.729 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.534 ' HD3' ' N ' ' A' ' 15' ' ' ALA . 46.5 Cg_exo -58.09 -49.46 12.6 Favored 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 122.726 2.284 . . . . 0.0 113.955 -178.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.45 ' HD2' ' N ' ' A' ' 16' ' ' PRO . 53.2 Cg_endo -68.52 -158.48 0.04 OUTLIER 'Trans proline' 0 C--N 1.354 0.852 0 C-N-CA 122.057 1.838 . . . . 0.0 112.484 -178.543 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.0 mm-40 -73.94 63.34 0.92 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.956 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.715 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 2.1 tp10 -104.55 14.62 29.62 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.817 -179.67 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.591 HE22 ' HG2' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -53.47 -62.79 1.42 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.356 -179.468 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.564 ' HE3' ' HA ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER -55.63 -20.68 14.67 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.361 -178.079 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.659 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 0.8 OUTLIER -73.94 -78.63 0.09 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.04 0.448 . . . . 0.0 111.37 178.636 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.689 ' HA ' ' HE2' ' A' ' 11' ' ' MET . 0.0 OUTLIER -69.24 -96.35 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -176.665 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.607 ' HG ' ' HA ' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -61.4 1.52 0.2 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -175.038 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.546 ' O ' HD22 ' A' ' 24' ' ' LEU . . . 65.08 -117.18 9.86 Favored Glycine 0 N--CA 1.444 -0.794 0 N-CA-C 108.344 -1.903 . . . . 0.0 108.344 -174.3 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.552 ' HG3' HD23 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -75.9 -66.81 0.74 Allowed 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 169.345 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.607 ' HA ' ' HG ' ' A' ' 24' ' ' LEU . 22.1 tpt180 -160.36 5.51 0.08 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.273 -1.33 . . . . 0.0 107.89 176.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.691 ' HA ' HD13 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -59.28 -74.6 0.07 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.169 -1.378 . . . . 0.0 114.394 -172.554 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.587 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.2 OUTLIER -33.17 -49.1 0.64 Allowed Pre-proline 0 CA--C 1.542 0.639 0 N-CA-C 113.256 0.835 . . . . 0.0 113.256 -175.204 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.575 ' CD ' ' HB2' ' A' ' 24' ' ' LEU . 38.0 Cg_exo -61.82 -40.15 46.94 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 122.513 2.142 . . . . 0.0 113.669 -178.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.691 HD13 ' HA ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -70.13 -47.76 60.36 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 -179.347 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.796 HG12 HG11 ' A' ' 69' ' ' VAL . 0.5 OUTLIER -73.1 -13.2 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.637 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.878 177.478 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.652 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 45.7 tt0 -62.41 -41.04 98.38 Favored 'General case' 0 CA--C 1.518 -0.256 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 177.594 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.85 -29.97 70.02 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 175.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.593 ' SD ' HG13 ' A' ' 69' ' ' VAL . 4.7 mtt -101.75 26.19 7.72 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.23 178.191 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.652 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 3.2 p-80 -62.38 -32.76 10.07 Favored Pre-proline 0 CA--C 1.537 0.479 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -176.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.544 ' HD3' ' ND1' ' A' ' 36' ' ' HIS . 55.0 Cg_exo -36.43 -30.78 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.282 0 C-N-CA 122.151 1.901 . . . . 0.0 112.211 179.171 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.666 HG22 HG12 ' A' ' 73' ' ' VAL . 3.5 m -78.21 -89.13 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.73 176.474 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.515 HD13 ' H ' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -171.51 59.44 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.168 177.975 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.493 ' HB1' ' O ' ' A' ' 32' ' ' ILE . . . -43.57 -39.47 3.49 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.6 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.587 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.83 -56.49 9.83 Favored Glycine 0 C--N 1.329 0.186 0 CA-C-N 116.044 -0.525 . . . . 0.0 113.818 -179.186 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.631 ' HE2' ' SD ' ' A' ' 46' ' ' MET . 2.8 tptm -77.46 -37.48 51.36 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 -178.048 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.582 HD11 HG22 ' A' ' 32' ' ' ILE . 45.7 mt -53.74 -57.0 6.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.007 -178.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.637 ' HA ' HD23 ' A' ' 28' ' ' LEU . 9.8 t -49.25 -40.25 33.41 Favored 'General case' 0 N--CA 1.457 -0.115 0 CA-C-O 121.006 0.432 . . . . 0.0 110.073 177.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.742 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -50.33 -68.68 1.33 Allowed Glycine 0 N--CA 1.45 -0.426 0 CA-C-N 115.572 -0.74 . . . . 0.0 112.927 179.635 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.631 ' SD ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.19 -46.4 75.85 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -178.5 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.705 HD12 ' HB2' ' B' ' 7' ' ' ASN . 2.8 mm? -80.23 7.29 9.72 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 111.698 0.259 . . . . 0.0 111.698 -179.063 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.61 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.23 -13.24 60.03 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.9 0.381 . . . . 0.0 110.637 179.585 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.536 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 3.3 mt-10 -78.3 19.28 0.46 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.484 178.252 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.711 HD11 ' NZ ' ' A' ' 68' ' ' LYS . 2.3 tt -83.12 163.5 2.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.02 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.666 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 3.6 m-20 -71.12 158.95 35.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.731 -179.418 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.508 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 4.8 m120 -88.41 -29.08 20.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.837 -0.619 . . . . 0.0 109.676 176.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.91 -30.36 62.55 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 177.025 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.666 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 0.4 OUTLIER -76.93 -29.2 55.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.522 178.675 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.552 HD23 ' HG3' ' A' ' 26' ' ' GLU . 0.6 OUTLIER -59.32 -47.49 85.2 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.986 0.422 . . . . 0.0 110.364 179.777 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.425 ' HA ' HD22 ' A' ' 56' ' ' LEU . 1.3 tm? -60.7 -41.65 95.62 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.474 179.213 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.525 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 0.2 OUTLIER -61.69 -41.8 98.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.615 179.101 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.711 ' HE3' ' HD3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -62.09 -36.72 82.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.128 178.749 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.504 HD13 ' NE ' ' A' ' 27' ' ' ARG . 4.4 tt -71.09 -19.79 62.42 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.407 178.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.525 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 2.6 pt-20 -106.01 -2.46 22.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.148 -179.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.585 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 9.1 m -123.16 78.87 52.23 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.933 -179.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -55.79 -36.47 95.31 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.124 1.883 . . . . 0.0 112.059 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.443 ' HG2' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.7 -46.6 18.68 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.883 -179.065 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.585 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 14.1 m -71.15 -50.46 33.18 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.952 0.406 . . . . 0.0 111.311 -178.008 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.603 HD22 HD11 ' A' ' 31' ' ' LEU . 0.0 OUTLIER -57.95 -56.9 16.05 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.874 -179.242 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.543 ' N ' HD13 ' A' ' 65' ' ' LEU . 2.2 ttm180 -51.56 -30.78 22.03 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.744 -178.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.487 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 5.9 t -69.66 -38.54 77.14 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.031 0.444 . . . . 0.0 110.327 178.322 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.711 ' NZ ' HD11 ' A' ' 50' ' ' ILE . 8.7 mtpp -65.41 -58.55 5.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.189 178.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.796 HG11 HG12 ' A' ' 32' ' ' ILE . 49.5 t -62.75 -21.58 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.616 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.487 ' HB3' ' O ' ' A' ' 67' ' ' SER . 13.4 t0 -54.46 -48.97 71.14 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 177.089 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.42 ' OE1' HD13 ' B' ' 6' ' ' LEU . 21.6 tt0 -68.76 -32.62 72.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.602 176.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.785 ' HB3' ' HA ' ' A' ' 69' ' ' VAL . . . -58.29 -35.32 71.63 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.393 178.217 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.666 HG12 HG22 ' A' ' 38' ' ' THR . 25.3 t -67.0 -33.02 60.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.662 177.613 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.35 -38.01 71.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.123 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.774 HG12 ' HA ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -56.78 -33.38 40.81 Favored 'Isoleucine or valine' 0 C--O 1.231 0.092 0 CA-C-O 121.187 0.517 . . . . 0.0 109.916 179.17 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.473 ' HB2' HG12 ' A' ' 43' ' ' ILE . 2.9 tm? -69.37 -49.87 51.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.525 178.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.466 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 7.5 mm-40 -54.14 -35.44 62.23 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.601 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.0 -26.85 36.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.705 178.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.498 ' O ' ' HB3' ' A' ' 83' ' ' GLU . 5.0 t60 -67.3 -62.55 1.37 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.797 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -63.41 -13.41 39.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.08 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.466 ' HB2' ' O ' ' A' ' 77' ' ' GLN . . . -72.53 -57.72 3.93 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.063 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 1.4 mmtt -79.47 -16.1 56.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.879 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.498 ' HB3' ' O ' ' A' ' 79' ' ' HIS . 1.5 tt0 -79.73 -48.84 12.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.791 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -70.22 -10.29 58.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.205 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.71 -58.4 6.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.127 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -93.82 142.61 27.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.907 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.31 -6.22 56.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.983 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -87.43 100.58 12.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.97 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -103.51 177.17 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.98 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -94.54 135.17 36.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.942 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.57 116.57 12.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.85 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.31 132.71 38.75 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.093 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -118.67 31.3 6.73 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.822 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -96.39 77.52 0.74 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.605 -179.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.529 ' N ' ' HD2' ' A' ' 96' ' ' PRO . 61.8 t -86.67 -51.27 0.45 Allowed Pre-proline 0 C--N 1.329 -0.292 0 N-CA-C 111.416 0.154 . . . . 0.0 111.416 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.529 ' HD2' ' N ' ' A' ' 95' ' ' VAL . 38.1 Cg_endo -66.0 -29.73 48.58 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.114 1.876 . . . . 0.0 112.135 179.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -106.96 104.17 13.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.933 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 7.3 t . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.028 -0.987 . . . . 0.0 111.009 179.949 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 11.2 t . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.833 0.349 . . . . 0.0 110.934 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 3.9 t -90.94 87.8 2.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.059 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 5.7 tttp -86.77 54.03 3.03 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.815 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' SER . . . . . 0.501 ' HB2' ' O ' ' B' ' 7' ' ' ASN . 1.1 p -84.91 132.85 34.32 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.018 -179.688 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -105.23 -46.78 4.14 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.702 179.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.42 HD13 ' OE1' ' A' ' 71' ' ' GLU . 3.3 tp -70.84 -83.23 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.601 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . 0.705 ' HB2' HD12 ' A' ' 47' ' ' LEU . 1.6 t30 -76.02 134.43 71.35 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.694 178.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -79.87 -8.32 14.46 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 122.327 2.018 . . . . 0.0 112.305 179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' ASN . . . . . 0.489 ' H ' HD21 ' B' ' 7' ' ' ASN . 73.9 m-20 -123.67 57.46 1.18 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.012 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.15 95.88 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.379 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.536 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -125.01 131.82 53.34 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.585 179.004 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -47.66 167.68 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 121.2 0.524 . . . . 0.0 112.301 -178.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' PHE . . . . . 0.742 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.6 OUTLIER -87.11 83.55 7.43 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.69 179.126 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . 0.502 ' HB ' ' HD3' ' B' ' 15' ' ' PRO . 3.3 t -116.55 -50.63 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.343 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -176.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' PRO . . . . . 0.502 ' HD3' ' HB ' ' B' ' 14' ' ' VAL . 98.8 Cg_exo -44.48 -36.73 10.12 Favored 'Trans proline' 0 C--N 1.353 0.771 0 C-N-CA 122.327 2.018 . . . . 0.0 112.791 -178.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . 0.523 ' O ' ' HB2' ' A' ' 21' ' ' LYS . . . 76.48 -20.06 2.87 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.472 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.564 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 27.7 m -96.99 -171.46 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.546 0.212 . . . . 0.0 110.662 179.492 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.591 ' HG2' HE22 ' A' ' 20' ' ' GLN . 3.6 mttp -60.21 91.45 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.822 0.344 . . . . 0.0 110.84 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -80.25 129.8 34.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.841 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 92.19 17.49 46.65 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.363 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 60.8 t30 -86.69 52.92 2.64 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.907 0.384 . . . . 0.0 110.872 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 1.5 pt . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.137 -179.949 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.191 0 CA-C-O 120.137 -0.257 . . . . 0.0 112.535 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -72.29 -37.89 4.1 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.519 2.146 . . . . 0.0 112.39 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.26 106.26 12.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.034 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -81.54 80.41 1.74 Allowed Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.399 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.559 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 18.5 t -87.93 -50.46 0.42 Allowed Pre-proline 0 CA--C 1.533 0.305 0 N-CA-C 111.559 0.207 . . . . 0.0 111.559 -179.727 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.559 ' HD2' ' N ' ' A' ' 5' ' ' SER . 33.6 Cg_endo -64.24 -31.12 64.12 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 122.215 1.944 . . . . 0.0 112.289 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.418 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.3 OUTLIER -96.68 119.14 34.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.078 -179.763 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.772 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 5.2 t -88.0 -30.11 20.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.336 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.14 -37.07 76.37 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 176.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 17.3 t -70.1 -35.92 74.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.566 177.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.772 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 8.7 mtm -64.43 -35.52 81.19 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.129 177.732 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.626 ' HA ' ' HE1' ' A' ' 23' ' ' MET . 44.7 mt -52.71 -50.19 63.85 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.915 179.054 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.18 -28.83 69.06 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.875 177.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -101.76 23.92 10.63 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.931 -178.537 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.605 ' HB3' ' O ' ' A' ' 11' ' ' MET . . . -134.32 60.92 46.89 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 120.626 0.251 . . . . 0.0 110.851 179.427 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.528 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 51.8 Cg_exo -56.64 -50.53 11.48 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 122.742 2.295 . . . . 0.0 113.86 -178.237 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.528 ' HD3' ' HB2' ' A' ' 16' ' ' PRO . 20.0 Cg_exo -65.81 -165.24 0.08 OUTLIER 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 121.98 1.787 . . . . 0.0 112.274 -179.04 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -74.23 62.03 0.91 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.587 178.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.408 ' HA ' ' OE1' ' A' ' 19' ' ' GLU . 1.9 mm-40 -93.81 5.74 50.67 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.086 -179.003 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.543 ' O ' HD12 ' A' ' 24' ' ' LEU . 2.8 pp0? -46.9 -56.49 6.25 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.412 -177.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.938 ' HD2' ' HA ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER -56.15 -29.02 60.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.176 -179.163 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 14.9 tp60 -72.65 -73.86 0.19 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.483 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.626 ' HE1' ' HA ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.41 -97.87 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -176.926 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.722 HD22 ' HD3' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -62.22 3.65 0.17 Allowed 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -174.914 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.5 -118.7 13.22 Favored Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 108.274 -1.931 . . . . 0.0 108.274 -174.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.787 ' HG2' HG23 ' A' ' 50' ' ' ILE . 0.4 OUTLIER -75.59 -66.37 0.79 Allowed 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 106.962 -1.496 . . . . 0.0 106.962 168.105 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.722 ' HD3' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -159.81 5.99 0.09 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.009 -1.45 . . . . 0.0 108.0 174.164 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.601 HD23 ' HA ' ' A' ' 44' ' ' THR . 0.4 OUTLIER -59.64 -77.62 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.271 -1.331 . . . . 0.0 114.354 -173.061 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.512 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -33.15 -48.45 0.61 Allowed Pre-proline 0 CA--C 1.539 0.538 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -174.636 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.591 ' HD3' ' HA ' ' A' ' 24' ' ' LEU . 19.2 Cg_endo -62.13 -43.45 24.09 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.22 1.947 . . . . 0.0 113.448 -178.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.813 HD13 HG21 ' A' ' 69' ' ' VAL . 0.0 OUTLIER -71.32 -44.62 64.77 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 119.816 -0.754 . . . . 0.0 109.984 -179.645 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.6 HG22 HD11 ' A' ' 43' ' ' ILE . 0.5 OUTLIER -72.23 -13.34 16.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 177.689 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.641 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 57.7 tp60 -62.53 -41.75 99.07 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 176.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.83 -28.03 68.03 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 175.085 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.511 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 5.9 mtt -102.75 25.4 9.26 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.228 178.291 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.641 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 2.2 p-80 -64.39 -31.69 6.23 Favored Pre-proline 0 CA--C 1.536 0.421 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -176.526 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.541 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 51.8 Cg_exo -36.11 -31.74 0.1 OUTLIER 'Trans proline' 0 C--N 1.363 1.318 0 C-N-CA 122.125 1.884 . . . . 0.0 112.061 179.136 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.54 HG23 HG13 ' A' ' 73' ' ' VAL . 6.9 m -78.21 -88.92 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.578 176.144 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.598 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 7.7 tp -171.7 62.64 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.131 177.371 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.54 ' HB3' ' HB ' ' A' ' 32' ' ' ILE . . . -45.02 -41.2 7.22 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.544 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.512 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -52.17 -51.62 40.4 Favored Glycine 0 C--N 1.329 0.192 0 C-N-CA 121.172 -0.537 . . . . 0.0 113.587 -179.222 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.456 ' HA ' ' HD2' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -77.42 -40.44 43.49 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 122.719 -0.283 . . . . 0.0 111.68 -178.594 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.825 HD13 ' HA ' ' A' ' 73' ' ' VAL . 65.7 mt -53.7 -54.53 18.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.83 -179.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.601 ' HA ' HD23 ' A' ' 28' ' ' LEU . 11.4 t -53.47 -41.26 66.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.362 178.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.627 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -51.62 -67.45 1.99 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 121.009 -0.615 . . . . 0.0 112.85 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.666 ' HE3' HG22 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -55.35 -47.0 76.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.712 0.256 . . . . 0.0 111.575 -179.022 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.495 HD23 ' O ' ' A' ' 43' ' ' ILE . 3.1 mm? -80.28 8.23 7.85 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.625 0.231 . . . . 0.0 111.625 -179.216 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.627 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.1 OUTLIER -64.54 -13.26 51.81 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 121.017 0.437 . . . . 0.0 110.111 179.406 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.462 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.5 mt-10 -78.67 20.64 0.43 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.377 177.211 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.787 HG23 ' HG2' ' A' ' 26' ' ' GLU . 0.3 OUTLIER -83.26 157.03 3.79 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.672 -179.457 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.65 155.47 40.46 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.905 0.383 . . . . 0.0 111.745 -178.278 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.751 ' HA ' HD23 ' A' ' 55' ' ' LEU . 3.1 m120 -85.61 -28.98 24.45 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.06 177.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 62.6 m -74.19 -29.96 62.0 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.721 177.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.555 ' O ' ' HG2' ' A' ' 58' ' ' MET . 2.6 mm-40 -79.88 -29.39 39.96 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.638 179.062 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.751 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -58.99 -46.88 87.05 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.132 179.757 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.436 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 26.9 tp -62.16 -45.55 92.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.617 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -59.62 -28.49 67.26 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.17 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.628 ' SD ' ' HA ' ' A' ' 65' ' ' LEU . 32.1 mmt -69.51 -49.05 58.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.377 -179.375 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.656 HD23 ' NE ' ' A' ' 27' ' ' ARG . 0.2 OUTLIER -64.38 -21.23 66.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.092 -179.576 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -96.38 -4.56 41.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.062 0.458 . . . . 0.0 110.41 178.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.578 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 11.9 m -124.18 78.39 59.96 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.803 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -55.79 -33.73 88.99 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.138 1.892 . . . . 0.0 112.146 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -78.13 -49.44 13.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.828 -179.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.578 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 39.2 m -69.45 -45.38 69.21 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.853 0.359 . . . . 0.0 111.444 -178.272 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.64 ' HG ' ' N ' ' A' ' 66' ' ' ARG . 0.6 OUTLIER -57.92 -66.72 0.43 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.409 -178.835 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.64 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -47.06 -31.47 3.38 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.924 -178.884 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.513 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.5 OUTLIER -65.36 -44.27 88.18 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.164 0.507 . . . . 0.0 109.986 177.714 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.688 ' NZ ' HD13 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -65.86 -59.85 3.45 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.555 178.791 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.813 HG21 HD13 ' A' ' 31' ' ' LEU . 78.8 t -61.05 -19.67 20.46 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.018 179.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.513 ' HB3' ' O ' ' A' ' 67' ' ' SER . 7.1 t70 -55.7 -49.42 73.06 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 176.174 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.406 ' O ' HG12 ' A' ' 75' ' ' VAL . 22.2 tt0 -66.12 -32.53 74.03 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.677 176.239 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.758 ' HB2' ' HA ' ' A' ' 69' ' ' VAL . . . -57.74 -37.07 72.97 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.31 178.639 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.825 ' HA ' HD13 ' A' ' 43' ' ' ILE . 24.6 t -65.04 -32.57 58.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.642 177.465 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.05 -36.62 66.93 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.205 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.724 HG11 ' HA ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.85 -29.45 40.49 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.129 0 CA-C-O 121.02 0.438 . . . . 0.0 110.098 179.111 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.598 ' HG ' ' HB3' ' A' ' 39' ' ' LEU . 2.6 tm? -70.34 -51.01 33.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.375 178.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -58.06 -35.54 71.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.457 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.27 -17.91 47.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.006 179.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.508 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 56.9 t-80 -69.55 -61.43 1.79 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.966 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -64.79 -24.83 67.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.073 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -72.7 -54.16 9.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.2 -179.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.77 -18.13 62.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.111 -179.448 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.508 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 2.4 tp10 -80.16 -50.99 9.51 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.924 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -68.78 -25.96 64.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.082 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -84.19 25.46 0.84 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.262 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.418 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 2.5 mm-40 -89.18 34.57 0.8 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.861 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.2 mtmp? -85.41 115.95 23.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.931 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -89.71 9.04 28.64 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.052 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 14.1 p -88.43 -26.22 5.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.996 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -82.11 120.24 25.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.899 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.4 m -81.05 -77.45 0.21 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.893 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -92.71 147.25 23.02 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.043 179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -116.39 89.5 3.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.994 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -98.32 64.29 0.81 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.366 179.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 16.5 t -105.51 100.81 28.35 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 120.657 0.265 . . . . 0.0 111.087 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -74.57 -170.06 0.69 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.512 2.142 . . . . 0.0 112.291 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -107.22 -78.44 0.58 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.001 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 7.1 p . . . . . 0 C--O 1.249 1.078 0 CA-C-O 117.987 -1.006 . . . . 0.0 111.054 -179.886 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 2.8 m . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.873 0.368 . . . . 0.0 111.091 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 12.1 p -83.36 146.95 6.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.043 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 4.9 mtpp -95.31 89.09 5.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.895 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' SER . . . . . 0.459 ' HB2' ' O ' ' B' ' 7' ' ' ASN . 0.9 OUTLIER -81.6 -161.91 0.47 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.893 -179.815 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' ASN . . . . . 0.427 ' HB2' HG13 ' A' ' 75' ' ' VAL . 2.6 m-80 -104.07 -83.37 0.49 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.914 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.517 HD23 ' HG2' ' A' ' 68' ' ' LYS . 3.4 mt -62.72 -80.18 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.583 179.572 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . 0.483 HD21 ' H ' ' B' ' 9' ' ' ASN . 2.7 t30 -75.02 142.34 75.95 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.556 178.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -78.98 -12.18 14.71 Favored 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.318 2.012 . . . . 0.0 112.122 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' ASN . . . . . 0.564 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 69.9 m-20 -123.96 60.72 1.11 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.163 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.86 96.11 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.616 179.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.583 ' HG3' ' HH ' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -122.47 129.05 51.61 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.37 178.433 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -48.17 173.44 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.115 0.483 . . . . 0.0 112.126 -178.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' PHE . . . . . 0.483 ' CE1' ' HG ' ' A' ' 48' ' ' LEU . 0.3 OUTLIER -86.92 90.38 8.31 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.867 179.393 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . 0.839 ' H ' ' HD2' ' B' ' 15' ' ' PRO . 0.5 OUTLIER -119.51 -47.63 0.04 OUTLIER Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.798 -176.902 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' PRO . . . . . 0.839 ' HD2' ' H ' ' B' ' 14' ' ' VAL . 9.8 Cg_endo -51.07 -39.71 60.16 Favored 'Trans proline' 0 C--N 1.353 0.777 0 C-N-CA 122.201 1.934 . . . . 0.0 112.582 -178.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.44 -23.64 2.81 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.384 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.938 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 1.9 p -94.97 -174.1 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 110.351 -0.24 . . . . 0.0 110.351 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.481 ' HG2' ' NE2' ' A' ' 20' ' ' GLN . 7.6 mttt -59.89 88.71 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.89 0.376 . . . . 0.0 110.63 179.783 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.583 ' HH ' ' HG3' ' B' ' 11' ' ' LYS . 1.7 t80 -81.04 112.8 18.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.941 -179.324 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 87.69 54.91 2.4 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.514 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -96.57 83.19 3.45 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.876 0.369 . . . . 0.0 110.819 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 1.7 mt . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.311 -0.852 . . . . 0.0 111.05 -179.929 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.186 0 N-CA-C 112.533 -0.227 . . . . 0.0 112.533 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -67.69 98.56 0.5 Allowed 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.591 2.194 . . . . 0.0 112.214 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.7 8.37 20.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.016 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -94.54 20.5 48.05 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.32 179.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.617 ' N ' ' HA ' ' A' ' 6' ' ' PRO . 0.7 OUTLIER -83.49 -38.77 0.73 Allowed Pre-proline 0 CA--C 1.537 0.479 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -179.447 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.617 ' HA ' ' N ' ' A' ' 5' ' ' SER . 10.3 Cg_exo -71.6 -57.24 0.14 OUTLIER 'Cis proline' 0 C--N 1.359 1.086 0 CA-C-N 119.738 0.942 . . . . 0.0 112.974 -0.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.438 ' O ' ' HB2' ' A' ' 5' ' ' SER . 1.9 mt -98.14 -168.28 1.63 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.263 -178.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.85 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 10.8 t -87.68 -29.76 20.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.473 -179.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.422 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.45 -37.2 77.55 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 176.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.3 t -70.56 -33.77 71.48 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.591 177.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.85 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.3 mtm -64.09 -35.74 81.75 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 177.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.652 HD11 ' SD ' ' A' ' 23' ' ' MET . 1.7 mp -52.32 -54.27 33.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.02 178.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.31 -26.68 67.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.244 178.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.7 p -101.64 15.57 28.51 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.881 -178.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.663 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -134.96 125.05 16.97 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 120.583 0.23 . . . . 0.0 111.209 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -62.8 169.73 8.28 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.456 2.104 . . . . 0.0 111.645 179.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.421 ' O ' ' HG3' ' A' ' 20' ' ' GLN . 17.0 Cg_endo -57.15 -33.04 95.12 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.384 2.056 . . . . 0.0 112.061 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.83 -7.15 51.12 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.306 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.663 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -91.42 19.26 6.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.947 -179.624 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.595 ' NE2' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -54.24 -65.47 0.57 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.265 -179.55 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.604 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -56.34 -19.59 15.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.733 -177.693 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.604 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 16.6 tp60 -72.72 -80.59 0.06 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.028 0.442 . . . . 0.0 111.322 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.652 ' SD ' HD11 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.91 -95.41 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.658 -177.374 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.595 HD13 ' HD3' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -62.46 -2.38 1.04 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -175.06 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.592 ' O ' HD22 ' A' ' 24' ' ' LEU . . . 65.29 -116.35 8.71 Favored Glycine 0 N--CA 1.445 -0.763 0 N-CA-C 108.419 -1.872 . . . . 0.0 108.419 -173.77 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.562 ' HG3' HD21 ' A' ' 55' ' ' LEU . 0.6 OUTLIER -76.65 -69.88 0.49 Allowed 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 169.407 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.694 ' HD2' ' HG2' ' A' ' 30' ' ' PRO . 12.8 tpt180 -160.11 14.33 0.13 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.325 -1.307 . . . . 0.0 107.951 175.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.568 ' HA ' HD12 ' A' ' 31' ' ' LEU . 3.9 mm? -57.76 -76.2 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.423 -1.262 . . . . 0.0 113.329 -174.281 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.607 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -39.02 -47.11 3.68 Favored Pre-proline 0 CA--C 1.538 0.517 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -175.815 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.694 ' HG2' ' HD2' ' A' ' 27' ' ' ARG . 52.1 Cg_exo -57.36 -43.31 53.2 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.333 2.022 . . . . 0.0 113.817 -178.145 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.568 HD12 ' HA ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -70.58 -47.44 60.24 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.395 0.617 . . . . 0.0 109.955 -178.488 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.743 HG12 HG13 ' A' ' 69' ' ' VAL . 0.7 OUTLIER -73.99 -13.15 15.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.227 178.468 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.645 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.2 OUTLIER -62.54 -40.85 98.1 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 176.834 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.13 -30.06 70.47 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 174.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.571 ' SD ' HG12 ' A' ' 69' ' ' VAL . 6.6 mtt -101.69 25.93 7.96 Favored 'General case' 0 N--CA 1.461 0.09 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.443 178.199 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.645 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.8 p-80 -65.32 -32.87 6.85 Favored Pre-proline 0 CA--C 1.535 0.392 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 -177.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.551 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 57.3 Cg_exo -36.69 -33.01 0.13 Allowed 'Trans proline' 0 C--N 1.36 1.181 0 C-N-CA 122.183 1.922 . . . . 0.0 112.182 179.407 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.407 ' HB ' ' H ' ' A' ' 39' ' ' LEU . 1.1 m -79.06 -86.31 0.07 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.982 -0.553 . . . . 0.0 109.732 176.573 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.503 ' HB2' HD12 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -171.36 65.03 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.194 0 CA-C-O 120.719 0.295 . . . . 0.0 111.371 177.982 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.525 ' HB1' ' HB ' ' A' ' 32' ' ' ILE . . . -52.62 -29.1 24.24 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.127 179.165 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.607 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -49.49 -56.83 10.24 Favored Glycine 0 N--CA 1.452 -0.234 0 CA-C-N 115.805 -0.634 . . . . 0.0 114.053 -178.38 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.59 ' O ' ' HG2' ' A' ' 46' ' ' MET . 0.0 OUTLIER -77.93 -37.99 46.47 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -177.345 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.74 ' HB ' HD11 ' A' ' 32' ' ' ILE . 22.0 mt -53.18 -54.19 18.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 C-N-CA 120.952 -0.299 . . . . 0.0 111.562 -177.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.535 HG22 ' CD2' ' A' ' 29' ' ' PHE . 5.1 t -46.8 -49.46 19.89 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.402 ' CA ' ' HB2' ' B' ' 13' ' ' PHE . . . -55.16 -48.56 67.56 Favored Glycine 0 N--CA 1.449 -0.451 0 CA-C-N 115.878 -0.601 . . . . 0.0 112.796 178.615 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.59 ' HG2' ' O ' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -54.94 -69.78 0.12 Allowed 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.461 0.648 . . . . 0.0 111.066 -179.079 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.668 HD23 ' HB2' ' B' ' 7' ' ' ASN . 2.5 mp -80.03 17.64 0.96 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.832 -177.142 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.584 ' HB3' ' HD2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -65.98 -23.47 66.59 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 121.161 0.505 . . . . 0.0 109.755 177.009 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.533 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 1.2 mt-10 -74.58 23.46 0.09 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.01 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.504 ' H ' ' C ' ' A' ' 48' ' ' LEU . 3.5 tt -84.7 169.52 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.932 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.525 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 30.6 m-20 -70.96 159.59 34.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.615 -179.569 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.515 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 8.0 m120 -89.09 -28.31 20.19 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.897 177.232 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -74.05 -30.15 62.26 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 177.144 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.525 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 1.2 mm-40 -78.87 -28.77 44.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.656 178.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.562 HD21 ' HG3' ' A' ' 26' ' ' GLU . 0.7 OUTLIER -59.18 -45.93 89.73 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.07 179.6 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.642 ' HA ' HD22 ' A' ' 59' ' ' LEU . 7.1 tt -60.1 -49.97 75.54 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.6 179.022 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -58.59 -32.05 68.61 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.284 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.543 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -62.85 -55.62 24.66 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.067 -179.77 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.642 HD22 ' HA ' ' A' ' 56' ' ' LEU . 2.3 pp -66.14 -6.21 12.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.028 0.442 . . . . 0.0 110.369 178.62 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.521 ' O ' ' HG3' ' A' ' 60' ' ' GLU . 9.4 tp10 -105.12 -13.95 15.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.606 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.526 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -122.66 91.37 49.56 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.966 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -63.79 -31.25 68.57 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.303 2.002 . . . . 0.0 112.151 179.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.579 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.61 -45.44 21.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.15 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.579 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 19.1 m -72.73 -56.36 5.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.011 0.434 . . . . 0.0 111.537 -178.633 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.625 HD13 ' N ' ' A' ' 66' ' ' ARG . 0.2 OUTLIER -57.86 -60.69 3.32 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.621 -177.999 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.625 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -51.78 -35.41 43.72 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.22 -177.752 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.516 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 2.8 m -65.52 -37.76 87.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.102 0.477 . . . . 0.0 110.194 178.23 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.448 ' HE3' ' CD1' ' A' ' 50' ' ' ILE . 0.5 OUTLIER -66.39 -55.08 17.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.574 179.019 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.833 ' HA ' ' HB1' ' A' ' 72' ' ' ALA . 61.4 t -67.99 -16.14 20.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.564 179.504 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.561 ' O ' HG23 ' A' ' 73' ' ' VAL . 8.7 t70 -58.04 -49.46 76.8 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 176.101 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.533 ' O ' ' HB2' ' A' ' 74' ' ' ALA . 0.4 OUTLIER -68.9 -20.07 64.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.734 176.354 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.833 ' HB1' ' HA ' ' A' ' 69' ' ' VAL . . . -65.63 -47.72 74.64 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.732 179.434 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.674 ' HA ' HD13 ' A' ' 43' ' ' ILE . 2.4 m -57.17 -30.5 34.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 176.62 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.533 ' HB2' ' O ' ' A' ' 71' ' ' GLU . . . -68.33 -32.18 72.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.837 178.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.562 HG22 ' N ' ' A' ' 76' ' ' LEU . 1.2 m -60.81 -30.91 48.17 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.131 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 178.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.562 ' N ' HG22 ' A' ' 75' ' ' VAL . 30.6 mt -67.82 -50.55 56.11 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.271 0.557 . . . . 0.0 109.602 176.276 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -51.53 -39.18 57.21 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.343 179.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.442 ' O ' ' HB2' ' A' ' 82' ' ' LYS . . . -81.93 -25.11 35.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.848 177.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.414 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 11.9 t-160 -71.27 -25.47 62.47 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.956 -179.557 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -83.59 -39.57 20.17 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.86 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -73.51 -37.96 65.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.433 -179.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.442 ' HB2' ' O ' ' A' ' 78' ' ' ALA . 3.0 mptm? -73.37 -27.6 61.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.151 -179.29 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.441 ' O ' ' HB2' ' A' ' 87' ' ' LYS . 8.8 tt0 -87.03 -21.4 26.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.006 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -80.09 11.32 3.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.378 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -82.33 -68.33 0.71 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.23 -179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -81.28 3.81 22.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.067 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.441 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.4 tttm -87.71 127.63 35.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.847 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -83.98 81.21 8.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.989 179.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.6 t -80.15 78.37 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.987 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 31.8 m120 -93.78 97.07 10.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.906 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 27.0 m -83.05 4.56 25.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.914 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.78 96.64 2.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.015 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 12.9 p -92.95 -68.91 0.77 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.915 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -86.11 -117.88 0.99 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.532 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.2 t -81.36 126.61 76.07 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 120.581 0.229 . . . . 0.0 111.086 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -68.86 92.82 0.44 Allowed 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.469 2.112 . . . . 0.0 112.287 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.2 p -89.18 -56.86 3.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.972 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 14.9 p . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.109 -0.948 . . . . 0.0 111.171 -179.926 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . 0.414 HG21 ' N ' ' B' ' 2' ' ' VAL . 7.2 p . . . . . 0 N--CA 1.485 1.311 0 CA-C-O 120.853 0.359 . . . . 0.0 111.04 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . 0.414 ' N ' HG21 ' B' ' 1' ' ' VAL . 20.0 t -99.67 108.02 21.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.064 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 21.4 tttt -85.25 112.34 20.67 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.814 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' SER . . . . . 0.457 ' HG ' ' HB ' ' A' ' 75' ' ' VAL . 0.6 OUTLIER -89.65 -175.49 4.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.038 -179.975 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -104.96 -36.89 7.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.981 179.792 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.461 ' HB3' ' CD2' ' A' ' 47' ' ' LEU . 0.0 OUTLIER -82.78 -79.0 0.2 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.818 179.678 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . 0.668 ' HB2' HD23 ' A' ' 47' ' ' LEU . 6.2 t30 -84.98 127.63 63.76 Favored Pre-proline 0 C--N 1.331 -0.219 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.129 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -80.17 13.48 2.19 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 122.357 2.038 . . . . 0.0 111.884 178.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' ASN . . . . . 0.506 ' HB3' ' OE2' ' A' ' 49' ' ' GLU . 25.8 m-20 -123.61 28.31 7.02 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.31 -179.501 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . 0.502 ' CB ' ' HB3' ' A' ' 46' ' ' MET . . . -59.39 96.41 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.818 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.533 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 1.7 mttp -130.11 -178.4 4.72 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.473 178.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -68.87 161.34 28.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.658 0.266 . . . . 0.0 111.061 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' PHE . . . . . 0.408 ' O ' ' HD3' ' B' ' 15' ' ' PRO . 1.0 OUTLIER -88.42 111.15 21.45 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.957 0.408 . . . . 0.0 110.697 179.427 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -112.39 88.79 11.36 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.399 178.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' PRO . . . . . 0.408 ' HD3' ' O ' ' B' ' 13' ' ' PHE . 51.9 Cg_exo -55.06 -176.39 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.814 2.342 . . . . 0.0 112.842 -178.535 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.01 -40.93 3.02 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.522 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 17.1 m -115.45 149.85 17.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.798 0.332 . . . . 0.0 111.301 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.525 ' HG2' HE22 ' A' ' 20' ' ' GLN . 24.0 mttp -74.78 93.05 2.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.516 179.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.584 ' HD2' ' HB3' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -65.02 118.42 9.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.983 -179.449 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 91.0 31.83 9.52 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.548 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 14.8 t30 -100.66 -0.19 37.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.843 0.354 . . . . 0.0 110.976 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 2.1 tp . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.255 -0.878 . . . . 0.0 111.007 -179.945 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 112.414 -0.275 . . . . 0.0 112.414 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -80.49 51.46 3.93 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.678 2.252 . . . . 0.0 112.409 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.6 mp -77.89 -44.68 26.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.873 179.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -104.42 -33.53 3.88 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.379 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 34.0 t -80.95 121.59 80.99 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 120.545 0.212 . . . . 0.0 110.871 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -68.18 147.69 73.32 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.524 2.15 . . . . 0.0 112.233 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.421 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.2 OUTLIER -100.96 -35.73 9.28 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.368 -179.284 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.797 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 8.0 t -87.77 -29.79 20.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.718 -178.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.459 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.55 -38.31 80.73 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 176.703 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.9 t -67.61 -35.04 78.21 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.459 -0.792 . . . . 0.0 109.347 176.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.797 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.7 mtm -64.42 -34.58 78.52 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.945 177.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.484 ' O ' ' HD3' ' A' ' 16' ' ' PRO . 1.2 mp -54.88 -44.83 74.41 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.367 179.036 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.3 -37.18 84.82 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.884 178.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.28 47.02 0.92 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.989 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.696 ' O ' ' HB2' ' A' ' 19' ' ' GLU . . . -132.52 -41.55 0.03 OUTLIER Pre-proline 0 CA--C 1.537 0.461 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -177.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.71 ' HA ' ' O ' ' A' ' 17' ' ' PRO . 70.6 Cg_exo -46.35 153.59 1.08 Allowed 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 121.789 1.659 . . . . 0.0 112.814 -176.493 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.71 ' O ' ' HA ' ' A' ' 16' ' ' PRO . 59.8 Cg_endo -72.12 -101.91 0.0 OUTLIER 'Cis proline' 0 CA--C 1.539 0.751 0 C-N-CA 123.968 -1.263 . . . . 0.0 114.493 2.223 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.18 67.9 1.4 Allowed 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -175.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.696 ' HB2' ' O ' ' A' ' 15' ' ' ALA . 1.4 tp10 -105.97 14.12 28.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.631 0.253 . . . . 0.0 110.838 176.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.609 ' NE2' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -46.88 -55.67 7.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.34 -178.386 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.702 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -56.26 -24.2 41.24 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.84 -178.571 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.572 ' H ' ' HD3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -72.54 -78.36 0.09 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.899 0.38 . . . . 0.0 111.862 -179.299 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.552 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.29 -95.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -176.37 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.552 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -60.39 -0.23 0.23 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -175.353 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 65.18 -115.69 8.02 Favored Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 108.431 -1.868 . . . . 0.0 108.431 -174.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.835 ' HG3' HD21 ' A' ' 55' ' ' LEU . 0.5 OUTLIER -75.52 -70.11 0.45 Allowed 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 168.64 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.614 ' NE ' HD22 ' A' ' 59' ' ' LEU . 12.7 tpt85 -160.37 10.53 0.1 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.152 -1.385 . . . . 0.0 107.67 174.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.791 HD23 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -58.88 -72.62 0.1 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 114.236 -1.347 . . . . 0.0 113.778 -173.025 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.662 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -35.81 -49.31 1.48 Allowed Pre-proline 0 CA--C 1.538 0.503 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -176.134 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.493 ' O ' ' HB3' ' A' ' 33' ' ' GLN . 53.0 Cg_exo -58.69 -42.39 54.19 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.436 2.091 . . . . 0.0 113.633 -178.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.847 ' HB3' HD12 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.09 -47.64 61.03 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.07 0.462 . . . . 0.0 109.998 -178.559 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.774 HD13 ' HB ' ' A' ' 43' ' ' ILE . 0.5 OUTLIER -75.07 -12.06 14.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.199 178.258 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.607 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 50.3 tp60 -62.39 -39.23 92.54 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 177.174 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.58 -30.23 67.95 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.011 174.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.625 ' HE1' ' HA ' ' A' ' 66' ' ' ARG . 6.7 mtt -100.55 28.25 5.22 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.333 178.116 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.607 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -64.96 -31.33 5.26 Favored Pre-proline 0 CA--C 1.536 0.433 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.324 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.576 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 55.7 Cg_exo -35.28 -33.03 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.265 0 C-N-CA 122.365 2.043 . . . . 0.0 112.535 179.549 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.402 ' N ' ' O ' ' A' ' 36' ' ' HIS . 67.8 m -78.18 -85.31 0.07 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.122 177.377 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.558 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.2 OUTLIER -171.19 50.85 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.547 179.014 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.509 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -37.02 -38.81 0.2 Allowed 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -179.536 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.662 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -44.23 -63.74 2.25 Favored Glycine 0 C--N 1.33 0.206 0 CA-C-N 115.998 -0.546 . . . . 0.0 114.208 -179.265 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.641 ' HZ2' ' HG2' ' B' ' 12' ' ' GLU . 0.8 OUTLIER -77.48 -27.56 52.0 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.257 0.465 . . . . 0.0 112.257 -177.267 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.774 ' HB ' HD13 ' A' ' 32' ' ' ILE . 1.2 mt -54.01 -50.51 53.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.662 0.268 . . . . 0.0 111.195 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.791 ' HA ' HD23 ' A' ' 28' ' ' LEU . 10.6 t -55.4 -46.38 76.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.58 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.573 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -50.05 -59.38 7.58 Favored Glycine 0 N--CA 1.452 -0.253 0 CA-C-N 115.986 -0.552 . . . . 0.0 113.234 -179.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.499 ' SD ' ' HG3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -56.89 -53.51 57.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.659 0.266 . . . . 0.0 111.371 -178.92 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.702 HD12 ' HB2' ' B' ' 7' ' ' ASN . 2.8 mm? -80.3 10.97 3.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.767 -178.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.573 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.48 -20.53 66.39 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.827 0.346 . . . . 0.0 110.613 179.711 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.524 ' HB2' ' ND2' ' B' ' 7' ' ' ASN . 2.2 mt-10 -76.0 21.54 0.17 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.793 179.222 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.68 HG22 ' HG2' ' A' ' 26' ' ' GLU . 0.2 OUTLIER -83.55 163.41 2.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.915 -179.669 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.481 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 1.3 m-20 -70.61 155.67 40.44 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.763 -178.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.544 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 5.4 m120 -84.87 -29.94 24.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.861 177.418 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.665 ' HA ' HD23 ' A' ' 56' ' ' LEU . 18.3 m -74.09 -28.49 61.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.298 0.57 . . . . 0.0 109.677 177.021 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.518 ' O ' ' HG2' ' A' ' 58' ' ' MET . 0.2 OUTLIER -80.16 -28.28 38.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.402 178.839 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.835 HD21 ' HG3' ' A' ' 26' ' ' GLU . 0.8 OUTLIER -59.7 -47.52 85.33 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.684 -179.699 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.746 ' HA ' HD21 ' A' ' 59' ' ' LEU . 1.0 OUTLIER -64.31 -43.24 95.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.725 179.955 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 9.1 m-70 -58.8 -21.83 56.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.118 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.596 ' SD ' ' HE2' ' A' ' 68' ' ' LYS . 28.2 mmt -76.59 -49.54 16.07 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.472 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.746 HD21 ' HA ' ' A' ' 56' ' ' LEU . 2.6 pp -66.14 -10.63 42.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.673 0.273 . . . . 0.0 110.895 -179.703 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -106.8 -5.52 18.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.707 178.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.593 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 3.6 m -122.52 81.83 47.14 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.946 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -58.49 -33.74 98.23 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.239 1.959 . . . . 0.0 111.83 179.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -78.51 -48.84 14.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.82 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.593 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 15.5 m -70.98 -53.36 15.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.888 0.375 . . . . 0.0 111.533 -177.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.847 HD12 ' HB3' ' A' ' 31' ' ' LEU . 0.2 OUTLIER -58.01 -61.39 2.58 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.434 -178.405 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.625 ' HA ' ' HE1' ' A' ' 35' ' ' MET . 0.8 OUTLIER -49.69 -34.54 18.89 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.141 -177.679 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 15.1 m -68.37 -39.18 81.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.248 0.547 . . . . 0.0 110.149 178.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.596 ' HE2' ' SD ' ' A' ' 58' ' ' MET . 0.2 OUTLIER -65.99 -56.35 12.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.552 179.201 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.647 HG22 HD22 ' A' ' 65' ' ' LEU . 21.0 t -63.87 -20.74 27.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.345 178.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.601 ' O ' HG22 ' A' ' 73' ' ' VAL . 21.4 t70 -53.88 -48.68 69.83 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 176.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -68.28 -29.47 68.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.937 176.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.751 ' HA ' HG11 ' A' ' 75' ' ' VAL . . . -58.35 -47.22 84.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.001 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.774 ' HA ' HD11 ' A' ' 43' ' ' ILE . 2.0 m -58.84 -31.72 45.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 177.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.03 -39.39 79.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.3 179.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.751 HG11 ' HA ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -55.73 -29.74 25.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-O 120.948 0.404 . . . . 0.0 109.917 179.487 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.689 HD21 HG12 ' A' ' 43' ' ' ILE . 3.5 mm? -71.84 -51.01 24.58 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.338 177.341 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 -50.75 -34.76 28.46 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.223 -0.898 . . . . 0.0 110.004 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.406 ' HB1' ' HZ1' ' A' ' 82' ' ' LYS . . . -82.0 -31.33 31.13 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.684 177.575 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.443 ' O ' ' HB3' ' A' ' 83' ' ' GLU . 1.6 t60 -60.13 -65.55 0.66 Allowed 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.055 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -67.51 -2.7 6.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.091 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.6 -70.59 0.5 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.444 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.406 ' HZ1' ' HB1' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -73.75 -22.05 59.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.555 -178.788 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.478 ' O ' ' HG2' ' A' ' 86' ' ' GLN . 0.2 OUTLIER -74.58 -44.85 48.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.076 -179.577 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -80.02 -47.61 14.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.206 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -84.0 38.3 0.64 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.394 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.734 ' HB2' ' HB ' ' A' ' 89' ' ' VAL . 2.2 pt20 -73.7 110.48 8.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.998 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.8 -67.42 0.85 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.883 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -74.61 -5.06 40.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.034 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.734 ' HB ' ' HB2' ' A' ' 86' ' ' GLN . 2.8 t -98.24 144.95 10.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.926 179.815 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -102.28 -174.66 2.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.954 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -96.3 85.93 4.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.918 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -89.8 24.28 2.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.109 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 1.4 p -111.6 21.69 15.85 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.899 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -86.86 -70.97 1.3 Allowed Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.514 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 3.4 t -107.51 130.31 23.01 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 120.61 0.243 . . . . 0.0 110.863 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -61.91 118.09 4.96 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.444 2.096 . . . . 0.0 112.287 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 21.7 p -95.5 32.21 1.84 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.893 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 6.6 m . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.091 -0.956 . . . . 0.0 111.009 179.948 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 7.5 t . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.82 0.343 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . 0.406 HG22 ' N ' ' B' ' 3' ' ' LYS . 7.1 p -92.22 138.27 20.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.969 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . 0.406 ' N ' HG22 ' B' ' 2' ' ' VAL . 2.4 ttmm -94.29 101.45 13.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.794 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' SER . . . . . 0.468 ' HG ' ' HB2' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -90.19 -171.56 3.16 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.015 -179.717 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -115.6 -81.27 0.61 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.015 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.59 ' HB2' HD13 ' A' ' 47' ' ' LEU . 14.2 mt -64.0 -76.51 0.07 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.765 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . 0.702 ' HB2' HD12 ' A' ' 47' ' ' LEU . 2.0 t30 -76.62 126.57 85.87 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.669 179.066 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -74.61 -4.46 15.45 Favored 'Trans proline' 0 N--CA 1.46 -0.476 0 C-N-CA 122.307 2.005 . . . . 0.0 112.037 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -123.65 54.8 1.28 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.022 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . 0.468 ' HB2' ' HG ' ' B' ' 4' ' ' SER . . . -60.27 92.09 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.441 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.447 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 0.1 OUTLIER -109.47 165.76 11.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.628 179.137 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . 0.641 ' HG2' ' HZ2' ' A' ' 42' ' ' LYS . 1.8 tm-20 -67.85 165.07 18.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.65 179.374 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' PHE . . . . . 0.502 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.1 t80 -88.43 102.13 14.59 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.978 0.418 . . . . 0.0 110.635 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 45.5 t -109.49 92.88 12.59 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.033 178.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -55.68 -165.28 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 123.072 2.514 . . . . 0.0 113.063 -178.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . 0.42 ' C ' ' HE3' ' A' ' 21' ' ' LYS . . . 85.48 -52.12 4.58 Favored Glycine 0 N--CA 1.452 -0.261 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.323 -179.235 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 12.7 m -115.66 143.07 26.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.75 0.31 . . . . 0.0 111.013 179.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.702 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -61.66 97.12 0.07 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.725 179.849 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.29 125.67 25.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.932 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 85.5 34.63 13.43 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.417 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . 0.4 ' ND2' ' HG3' ' B' ' 18' ' ' LYS . 11.8 t30 -98.8 23.26 9.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.756 0.312 . . . . 0.0 111.023 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 12.2 pt . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.181 -0.914 . . . . 0.0 111.192 -179.843 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.189 0 CA-C-O 120.148 -0.251 . . . . 0.0 112.589 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -74.14 151.56 97.14 Favored 'Cis proline' 0 C--N 1.348 0.513 0 C-N-CA 123.318 -1.534 . . . . 0.0 112.439 0.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.506 ' H ' ' HG ' ' A' ' 3' ' ' LEU . 0.2 OUTLIER -98.64 74.69 2.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.887 179.84 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -100.37 123.76 8.03 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.535 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 36.2 t -81.89 139.65 46.6 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 120.574 0.226 . . . . 0.0 110.936 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_exo -56.81 -31.12 87.55 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.61 2.207 . . . . 0.0 112.229 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.465 ' O ' ' HG3' ' A' ' 11' ' ' MET . 1.0 OUTLIER -82.39 86.73 6.67 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.964 -179.744 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.737 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 10.5 t -88.01 -30.91 19.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.382 -179.816 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.36 -37.24 77.39 Favored 'General case' 0 N--CA 1.455 -0.225 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 177.201 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -70.72 -35.6 72.8 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.905 177.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.737 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 10.9 mtm -64.17 -36.85 85.42 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 177.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.644 HD11 ' HB3' ' A' ' 24' ' ' LEU . 1.4 mp -51.69 -52.43 48.31 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.975 179.047 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.45 -33.27 75.33 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.307 178.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.51 30.91 4.0 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.908 -178.118 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.466 ' HB1' ' O ' ' A' ' 11' ' ' MET . . . -147.24 120.21 4.85 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.044 179.18 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.462 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 19.6 Cg_endo -59.26 168.81 4.42 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.567 2.178 . . . . 0.0 111.82 179.1 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -58.05 -29.68 87.73 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.394 2.063 . . . . 0.0 112.158 179.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.46 -11.28 60.41 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.133 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.532 ' HA ' ' OE1' ' A' ' 19' ' ' GLU . 0.7 OUTLIER -88.5 12.2 15.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.792 -179.832 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.534 HE22 ' HB3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -46.73 -66.76 0.36 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.054 -0.521 . . . . 0.0 112.11 -177.568 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.717 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -56.74 -19.17 15.46 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -177.372 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.626 ' N ' ' HD2' ' A' ' 21' ' ' LYS . 1.8 tt0 -72.72 -78.05 0.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.911 0.386 . . . . 0.0 111.294 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.642 ' HA ' ' HE1' ' A' ' 11' ' ' MET . 0.0 OUTLIER -69.47 -97.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.419 -177.074 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.644 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -61.79 -1.04 0.54 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -175.836 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 65.1 -115.84 8.21 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 108.463 -1.855 . . . . 0.0 108.463 -174.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.834 ' HG3' HD21 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -76.06 -69.54 0.49 Allowed 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 169.447 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.587 HH11 HD22 ' A' ' 24' ' ' LEU . 6.3 tpt180 -159.63 12.21 0.13 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 114.309 -1.314 . . . . 0.0 108.107 176.622 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.763 ' HA ' HD12 ' A' ' 31' ' ' LEU . 3.8 mm? -57.76 -84.14 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.44 -1.255 . . . . 0.0 113.923 -173.412 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.635 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -32.66 -51.53 0.61 Allowed Pre-proline 0 CA--C 1.535 0.392 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -174.977 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.559 ' HG2' ' O ' ' A' ' 27' ' ' ARG . 10.0 Cg_endo -56.03 -41.98 71.32 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.479 2.119 . . . . 0.0 113.787 -177.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.763 HD12 ' HA ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -70.61 -48.81 53.27 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 120.019 -0.672 . . . . 0.0 109.748 -179.427 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.745 HG12 HG12 ' A' ' 69' ' ' VAL . 0.7 OUTLIER -72.17 -13.51 16.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.304 178.578 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.644 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 1.8 tp-100 -62.41 -40.01 95.15 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 177.312 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.71 -29.92 70.02 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.227 -0.897 . . . . 0.0 108.882 174.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.542 ' SD ' HG11 ' A' ' 69' ' ' VAL . 6.8 mtt -101.65 25.61 8.3 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.399 177.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.797 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 0.1 OUTLIER -64.07 -32.76 8.09 Favored Pre-proline 0 CA--C 1.536 0.429 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 -177.271 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.797 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 4.0 Cg_exo -36.21 -32.74 0.11 Allowed 'Trans proline' 0 C--N 1.364 1.343 0 C-N-CA 122.498 2.132 . . . . 0.0 112.099 179.33 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.817 HG21 HG11 ' A' ' 73' ' ' VAL . 0.2 OUTLIER -78.23 -87.23 0.06 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.898 176.83 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.73 ' HB3' HD22 ' A' ' 76' ' ' LEU . 0.3 OUTLIER -171.29 59.97 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.371 178.388 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.511 ' HB3' ' HB ' ' A' ' 32' ' ' ILE . . . -48.64 -31.36 6.6 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 120.894 0.378 . . . . 0.0 111.309 179.475 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.635 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -44.43 -63.99 2.21 Favored Glycine 0 N--CA 1.453 -0.225 0 CA-C-N 115.684 -0.689 . . . . 0.0 114.372 -178.505 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.572 ' HE3' ' HG3' ' B' ' 12' ' ' GLU . 0.0 OUTLIER -77.79 -29.61 50.93 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -176.999 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.676 ' HB ' HD13 ' A' ' 32' ' ' ILE . 15.9 mt -53.88 -53.92 23.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.467 -178.622 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.52 HG22 ' CD2' ' A' ' 29' ' ' PHE . 6.7 t -47.14 -46.6 23.36 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.143 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.624 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -53.44 -61.06 7.37 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.917 -0.583 . . . . 0.0 113.022 179.304 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.539 ' SD ' ' HG3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.45 -52.6 63.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.665 0.269 . . . . 0.0 111.492 -178.516 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.565 HD13 ' HB3' ' B' ' 6' ' ' LEU . 3.0 mm? -80.04 5.72 13.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.685 -178.327 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.458 ' C ' ' H ' ' A' ' 50' ' ' ILE . 0.0 OUTLIER -66.0 -16.58 64.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.837 0.351 . . . . 0.0 110.717 179.57 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.48 ' HG3' ' O ' ' B' ' 9' ' ' ASN . 3.4 mm-40 -76.65 18.84 0.3 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.807 179.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.568 HG21 ' HG2' ' A' ' 26' ' ' GLU . 0.4 OUTLIER -83.23 161.3 3.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.528 179.89 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.528 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 6.3 m-20 -70.49 155.51 40.61 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.98 0.419 . . . . 0.0 111.51 -178.394 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.516 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 5.1 m120 -83.33 -30.95 27.08 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.323 178.544 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.2 t -74.04 -33.7 63.82 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.302 0.572 . . . . 0.0 109.521 177.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.528 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -77.96 -24.93 47.95 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.552 179.445 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.834 HD21 ' HG3' ' A' ' 26' ' ' GLU . 0.7 OUTLIER -60.28 -48.11 83.15 Favored 'General case' 0 C--O 1.231 0.121 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 178.461 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.47 HD21 ' HA ' ' A' ' 56' ' ' LEU . 2.0 tm? -58.71 -39.88 82.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.094 178.679 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.473 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 12.9 t-80 -60.19 -40.21 89.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.543 178.707 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.543 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -62.21 -41.65 98.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.073 0.463 . . . . 0.0 110.309 178.815 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.444 HD13 ' NE ' ' A' ' 27' ' ' ARG . 8.1 tt -67.19 -19.51 65.58 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.7 178.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' A' ' 57' ' ' HIS . 5.2 pt-20 -105.03 -6.6 19.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.52 -178.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.556 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.3 OUTLIER -123.0 86.79 50.94 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.139 -179.69 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.446 ' O ' ' HB2' ' A' ' 66' ' ' ARG . 23.9 Cg_endo -61.3 -30.13 87.3 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.18 1.92 . . . . 0.0 111.863 179.038 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -78.09 -51.13 10.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.436 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.404 ' O ' ' HB2' ' A' ' 67' ' ' SER . 66.9 m -69.83 -50.43 42.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.633 -178.307 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.596 HD13 ' N ' ' A' ' 66' ' ' ARG . 0.0 OUTLIER -58.03 -59.77 4.75 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.282 -178.626 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.596 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -51.78 -30.27 22.31 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.618 -178.635 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.555 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 2.5 m -67.36 -37.71 83.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.314 178.356 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.52 ' O ' HD21 ' B' ' 6' ' ' LEU . 3.2 mtmm -65.72 -59.33 4.02 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.164 178.516 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.851 ' HA ' ' HB2' ' A' ' 72' ' ' ALA . 74.9 t -62.75 -18.71 21.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.58 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.555 ' HB3' ' O ' ' A' ' 67' ' ' SER . 7.3 t70 -56.92 -48.82 77.35 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 176.2 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.44 ' O ' HG13 ' A' ' 75' ' ' VAL . 43.8 tt0 -67.87 -29.31 68.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.628 176.24 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.851 ' HB2' ' HA ' ' A' ' 69' ' ' VAL . . . -59.27 -42.74 91.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.341 178.45 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.817 HG11 HG21 ' A' ' 38' ' ' THR . 14.6 t -60.73 -30.52 47.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 176.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.52 -31.88 63.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.056 178.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.787 HG12 ' HA ' ' A' ' 72' ' ' ALA . 1.1 m -61.0 -30.02 46.81 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.084 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 179.234 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.73 HD22 ' HB3' ' A' ' 39' ' ' LEU . 76.2 mt -65.94 -56.67 10.54 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 121.233 0.54 . . . . 0.0 109.942 177.227 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 21.2 mm100 -51.02 -36.11 37.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.026 -0.988 . . . . 0.0 110.591 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.81 -27.54 33.6 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.042 178.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.587 ' HB2' ' O ' ' A' ' 75' ' ' VAL . 0.9 OUTLIER -74.96 -23.0 58.22 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.196 -179.337 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -73.31 5.84 3.32 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.209 -179.474 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -80.51 -77.41 0.2 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.532 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -80.22 -24.78 39.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.758 -178.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.544 ' HB3' ' O ' ' A' ' 79' ' ' HIS . 37.3 tp10 -74.35 -31.9 62.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.585 -0.28 . . . . 0.0 111.245 -178.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -69.69 -4.11 18.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.373 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -69.84 -16.77 63.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.083 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 13.5 mt-30 -77.0 -67.02 0.75 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.928 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.39 88.26 3.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.818 179.705 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -82.5 -4.54 57.69 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.227 -179.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.5 p -79.68 96.18 2.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.039 0.447 . . . . 0.0 110.852 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -104.4 116.55 32.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.989 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.52 60.64 5.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.711 179.599 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.46 104.27 0.49 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.176 -179.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 8.2 t -98.29 -24.72 15.12 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.878 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -93.41 -118.03 2.71 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.539 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -106.89 135.95 19.5 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.678 0.275 . . . . 0.0 110.866 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.43 -155.95 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.559 2.173 . . . . 0.0 112.327 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.52 -68.73 0.59 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.905 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.084 -0.96 . . . . 0.0 110.998 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.815 0.341 . . . . 0.0 110.953 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 22.4 t -89.83 91.88 3.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.985 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.96 136.89 35.24 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.081 -179.602 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' SER . . . . . 0.446 ' HG ' ' HB3' ' B' ' 10' ' ' ALA . 0.2 OUTLIER -93.29 -165.69 1.38 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.918 179.819 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 -106.86 -80.66 0.56 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.832 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.565 ' HB3' HD13 ' A' ' 47' ' ' LEU . 9.7 tp -62.82 -81.36 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.769 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . 0.554 HD21 ' H ' ' B' ' 9' ' ' ASN . 1.3 t30 -78.75 130.03 71.92 Favored Pre-proline 0 C--N 1.332 -0.194 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.706 178.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.93 1.38 8.95 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.107 1.871 . . . . 0.0 112.108 179.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' ASN . . . . . 0.554 ' H ' HD21 ' B' ' 7' ' ' ASN . 17.2 m-80 -123.52 46.71 2.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.918 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . 0.446 ' HB3' ' HG ' ' B' ' 4' ' ' SER . . . -60.27 95.82 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.573 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -121.49 170.46 9.64 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.502 178.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . 0.572 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 2.3 tt0 -68.06 163.8 21.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.795 0.331 . . . . 0.0 111.03 179.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 13' ' ' PHE . . . . . 0.624 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.2 t80 -92.32 112.52 24.49 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.152 -179.545 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . 0.419 ' H ' HG21 ' B' ' 14' ' ' VAL . 0.6 OUTLIER -112.63 91.24 16.68 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.539 178.91 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 15' ' ' PRO . . . . . 0.546 ' HB3' ' HA ' ' A' ' 22' ' ' GLN . 50.6 Cg_exo -55.22 -175.55 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.695 2.264 . . . . 0.0 112.998 -178.747 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . 0.423 ' C ' ' HD3' ' A' ' 21' ' ' LYS . . . 85.28 -49.42 4.2 Favored Glycine 0 N--CA 1.452 -0.278 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.678 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 2.6 m -115.61 141.51 32.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.87 0.367 . . . . 0.0 111.246 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.717 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -62.32 100.98 0.2 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.954 -179.889 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -75.85 119.91 20.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.004 -179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.14 86.06 0.22 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.43 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -88.63 -90.72 0.13 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.839 0.352 . . . . 0.0 111.016 -179.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.328 -0.844 . . . . 0.0 111.058 -179.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.296 0 N-CA-C 112.414 -0.274 . . . . 0.0 112.414 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -59.75 -24.51 76.0 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.556 2.17 . . . . 0.0 112.142 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.74 102.87 2.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.86 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.413 ' O ' ' HD3' ' A' ' 6' ' ' PRO . . . -88.02 95.62 2.1 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.563 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -87.02 110.61 34.4 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-O 120.518 0.199 . . . . 0.0 111.02 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.43 ' HB2' ' HB2' ' A' ' 10' ' ' SER . 44.5 Cg_exo -57.19 118.52 5.4 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.649 2.232 . . . . 0.0 112.25 -179.806 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.1 mt -96.85 -69.6 0.75 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.968 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.798 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 10.8 t -87.99 -28.1 21.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.521 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.505 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.46 -38.26 80.31 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 176.857 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.43 ' HB2' ' HB2' ' A' ' 6' ' ' PRO . 10.7 t -71.13 -34.35 70.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.608 177.184 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.798 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 5.3 mtm -64.36 -33.92 76.96 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 177.139 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.525 HD12 ' SD ' ' A' ' 23' ' ' MET . 3.7 mp -52.79 -54.66 30.89 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.891 178.421 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.32 -25.92 67.06 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.242 178.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.1 m -101.66 14.02 33.2 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.963 -178.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.642 ' HB2' ' HB3' ' A' ' 19' ' ' GLU . . . -134.76 118.05 13.22 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 120.515 0.198 . . . . 0.0 111.281 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.425 ' HD2' ' OE1' ' A' ' 19' ' ' GLU . 47.3 Cg_exo -56.36 167.34 2.72 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.628 2.218 . . . . 0.0 112.008 179.39 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -54.29 -37.47 88.47 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.395 2.064 . . . . 0.0 112.366 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -72.21 -18.63 61.83 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.929 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.642 ' HB3' ' HB2' ' A' ' 15' ' ' ALA . 0.9 OUTLIER -85.1 16.01 3.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.92 179.885 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.52 ' HA ' ' HE3' ' A' ' 23' ' ' MET . 0.0 OUTLIER -60.87 -49.44 77.48 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.354 179.626 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.552 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -56.88 -21.74 31.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.255 -179.82 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.552 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 12.5 tp60 -73.84 -80.49 0.07 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.035 0.445 . . . . 0.0 111.641 179.562 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.592 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -70.05 -94.87 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -176.032 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.592 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -58.91 0.96 0.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -174.993 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.83 -117.13 9.87 Favored Glycine 0 N--CA 1.444 -0.791 0 N-CA-C 108.342 -1.903 . . . . 0.0 108.342 -174.488 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 51' ' ' ASP . 2.2 mp0 -76.06 -69.12 0.52 Allowed 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 169.083 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.689 ' HG3' HD22 ' A' ' 31' ' ' LEU . 1.7 tpt180 -159.99 9.27 0.1 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.259 -1.337 . . . . 0.0 107.939 175.065 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.858 HD23 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.59 -69.78 0.19 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 114.308 -1.315 . . . . 0.0 113.561 -173.61 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.57 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -37.93 -49.0 3.02 Favored Pre-proline 0 CA--C 1.538 0.503 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -175.847 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.597 ' HG2' ' HD2' ' A' ' 27' ' ' ARG . 46.5 Cg_exo -58.97 -43.89 39.52 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 122.37 2.046 . . . . 0.0 113.505 -178.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.773 HD13 ' HA ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -70.89 -46.02 63.32 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.216 -178.313 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.707 HD13 ' HB ' ' A' ' 43' ' ' ILE . 0.4 OUTLIER -74.96 -12.61 15.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.166 178.087 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.636 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -62.09 -39.77 93.57 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 176.557 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.46 -31.77 72.16 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.058 174.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.548 ' SD ' HG11 ' A' ' 69' ' ' VAL . 6.4 mtt -100.23 27.42 5.66 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.394 178.185 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.636 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 2.0 p-80 -65.31 -31.99 5.8 Favored Pre-proline 0 CA--C 1.536 0.431 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 -177.383 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.564 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 47.5 Cg_exo -35.78 -32.53 0.1 OUTLIER 'Trans proline' 0 C--N 1.361 1.209 0 C-N-CA 122.278 1.985 . . . . 0.0 112.597 179.709 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.438 ' O ' HD21 ' A' ' 39' ' ' LEU . 16.9 m -78.28 -83.27 0.09 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.131 177.144 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.658 ' HB3' HD13 ' A' ' 76' ' ' LEU . 0.2 OUTLIER -171.09 52.77 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.201 178.828 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.532 ' HB3' ' HA ' ' A' ' 36' ' ' HIS . . . -38.33 -42.54 0.72 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.97 -179.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.57 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -52.73 -49.44 53.62 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 121.046 -0.597 . . . . 0.0 113.641 -178.706 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.569 ' H ' HD11 ' A' ' 39' ' ' LEU . 0.1 OUTLIER -77.05 -36.7 55.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 117.061 0.431 . . . . 0.0 111.616 -178.491 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.764 HD11 ' HA ' ' A' ' 73' ' ' VAL . 0.4 OUTLIER -53.63 -62.62 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.724 0.297 . . . . 0.0 110.721 -179.846 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.858 ' HA ' HD23 ' A' ' 28' ' ' LEU . 8.9 t -48.56 -44.11 36.26 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.261 178.622 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.858 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -48.12 -67.79 1.47 Allowed Glycine 0 C--O 1.227 -0.289 0 CA-C-N 115.655 -0.702 . . . . 0.0 113.201 179.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.489 ' H ' ' HG2' ' A' ' 46' ' ' MET . 0.0 OUTLIER -54.68 -56.83 14.97 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.797 0.295 . . . . 0.0 111.797 -178.057 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.802 HD23 ' HB2' ' B' ' 7' ' ' ASN . 2.8 mp -79.99 17.42 0.98 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 -177.683 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.615 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.72 -18.09 65.19 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.121 0.486 . . . . 0.0 109.871 177.044 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.595 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.1 mt-10 -74.65 19.96 0.13 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.335 179.513 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.453 ' H ' ' C ' ' A' ' 48' ' ' LEU . 1.8 tt -83.29 162.74 3.11 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-O 120.828 0.347 . . . . 0.0 110.959 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.463 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 1.1 m-20 -71.18 154.73 41.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.102 -0.499 . . . . 0.0 112.288 -178.298 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.509 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 1.8 m120 -82.54 -27.39 31.68 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.551 176.192 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -74.19 -32.91 63.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.805 177.585 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -75.71 -28.7 58.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.419 178.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 52' ' ' ASN . 0.4 OUTLIER -59.84 -46.94 87.7 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.149 179.288 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.57 -48.6 78.89 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.505 179.255 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -57.26 -40.12 77.01 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.865 179.776 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.551 ' SD ' ' HE2' ' A' ' 68' ' ' LYS . 12.9 mmt -64.41 -41.55 96.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.01 0.434 . . . . 0.0 110.294 179.104 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.9 tt -69.39 -14.99 63.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.78 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.58 -9.12 16.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.35 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.638 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -123.22 85.65 51.59 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.934 -179.678 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_endo -61.34 -33.1 89.76 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.295 1.997 . . . . 0.0 112.173 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.32 -46.36 20.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.463 -179.429 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 30.8 m -70.22 -48.39 57.26 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.859 0.361 . . . . 0.0 111.316 -178.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.638 ' HB3' ' O ' ' A' ' 61' ' ' SER . 0.1 OUTLIER -58.01 -58.57 7.82 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.749 -178.937 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.638 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -50.9 -34.07 26.87 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.241 -177.625 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.528 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 35.3 t -63.41 -41.95 98.75 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.118 0.485 . . . . 0.0 110.153 178.246 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.578 ' HG2' HD22 ' B' ' 6' ' ' LEU . 1.0 OUTLIER -66.21 -57.32 7.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.686 179.285 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.748 ' HA ' ' HB1' ' A' ' 72' ' ' ALA . 71.1 t -63.36 -19.08 23.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.775 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.6 ' O ' HG22 ' A' ' 73' ' ' VAL . 7.5 t70 -56.97 -48.85 77.42 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 176.539 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.87 -25.54 64.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.843 176.56 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.748 ' HB1' ' HA ' ' A' ' 69' ' ' VAL . . . -61.18 -48.78 79.99 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.845 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.764 ' HA ' HD11 ' A' ' 43' ' ' ILE . 2.6 m -58.68 -30.14 41.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 177.334 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.08 -37.98 78.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.287 -0.869 . . . . 0.0 111.196 179.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -57.31 -29.02 31.8 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 178.664 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.716 HD22 HG12 ' A' ' 43' ' ' ILE . 3.9 mm? -72.0 -50.7 26.47 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.073 177.081 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -51.38 -31.25 21.73 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.241 -0.891 . . . . 0.0 109.697 178.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.47 -30.09 33.51 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.581 177.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.4 ' O ' ' HB3' ' A' ' 83' ' ' GLU . 2.7 t-160 -59.28 -20.26 52.93 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.636 179.332 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.837 ' HA ' ' HG2' ' A' ' 83' ' ' GLU . 5.4 mt-30 -72.79 6.07 2.78 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.415 -179.494 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.65 -70.05 0.54 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.201 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.441 ' O ' ' HB1' ' A' ' 85' ' ' ALA . 8.0 mptt -80.32 -21.55 42.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.597 -178.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.837 ' HG2' ' HA ' ' A' ' 80' ' ' GLN . 0.7 OUTLIER -74.35 -35.7 63.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.888 0.375 . . . . 0.0 111.387 -178.758 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -72.36 6.97 1.98 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.568 -179.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.441 ' HB1' ' O ' ' A' ' 82' ' ' LYS . . . -63.89 -32.61 74.19 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.988 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -79.85 173.44 12.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.004 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.52 -1.72 56.74 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.977 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -89.41 26.88 1.57 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.092 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 5.4 p -96.44 7.77 7.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.904 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -89.89 50.19 1.84 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.062 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -83.09 172.68 12.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.798 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -79.01 89.73 4.78 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.941 179.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 72.2 p -117.6 110.88 18.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.005 -179.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -90.21 2.72 81.66 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.401 179.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.543 HG11 ' HA ' ' A' ' 96' ' ' PRO . 8.8 t -90.25 133.02 34.1 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-O 120.344 0.116 . . . . 0.0 110.954 -179.858 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.543 ' HA ' HG11 ' A' ' 95' ' ' VAL . 73.5 Cg_endo -78.09 -63.48 0.03 OUTLIER 'Cis proline' 0 C--N 1.349 0.565 0 C-N-CA 123.557 -1.434 . . . . 0.0 112.758 0.778 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.491 ' H ' ' HG2' ' A' ' 96' ' ' PRO . 4.8 t -107.98 -21.86 12.65 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.046 -179.585 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.6 m . . . . . 0 C--O 1.249 1.064 0 CA-C-O 117.965 -1.017 . . . . 0.0 111.111 -179.882 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . 0.405 ' H3 ' HG23 ' B' ' 1' ' ' VAL . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.418 0 CA-C-O 120.604 0.24 . . . . 0.0 110.758 . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 21.0 m -79.28 149.36 5.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.078 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.76 117.43 27.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.964 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 2.0 m -86.69 -175.54 5.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.687 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -103.98 -43.32 5.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.997 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.578 HD22 ' HG2' ' A' ' 68' ' ' LYS . 0.8 OUTLIER -80.62 -81.43 0.13 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.84 -179.982 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . 0.802 ' HB2' HD23 ' A' ' 47' ' ' LEU . 2.1 t30 -81.47 122.82 81.22 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.757 179.452 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -78.54 9.88 3.02 Favored 'Trans proline' 0 N--CA 1.459 -0.517 0 C-N-CA 122.16 1.906 . . . . 0.0 112.034 179.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' ASN . . . . . 0.525 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 56.5 m-20 -123.25 34.33 5.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.034 -179.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.77 90.01 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.654 -179.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.595 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 1.9 mttm -129.1 138.56 51.91 Favored 'General case' 0 C--O 1.226 -0.179 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.132 178.625 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -46.58 163.04 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -177.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 13' ' ' PHE . . . . . 0.858 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.7 OUTLIER -87.28 82.28 7.66 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.786 179.433 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . 0.544 HG23 ' HD3' ' B' ' 15' ' ' PRO . 1.7 m -118.15 -43.0 0.05 OUTLIER Pre-proline 0 CA--C 1.539 0.542 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -176.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 15' ' ' PRO . . . . . 0.544 ' HD3' HG23 ' B' ' 14' ' ' VAL . 86.2 Cg_exo -45.64 -39.67 18.05 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 122.262 1.975 . . . . 0.0 112.894 -178.59 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 77.78 -22.63 2.76 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.219 -179.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.533 HG23 ' H ' ' B' ' 18' ' ' LYS . 1.8 p -94.97 -176.37 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 110.373 -0.232 . . . . 0.0 110.373 179.27 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.533 ' H ' HG23 ' B' ' 17' ' ' VAL . 5.0 mttm -59.86 94.01 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.906 0.384 . . . . 0.0 110.825 -179.858 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.75 117.97 24.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.83 -179.679 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 79.33 47.56 7.37 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.823 -0.704 . . . . 0.0 112.529 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -95.27 -0.02 53.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.811 0.339 . . . . 0.0 110.883 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . 0.454 ' N ' HD12 ' B' ' 22' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.174 -0.917 . . . . 0.0 111.019 179.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.113 0 N-CA-C 112.496 -0.242 . . . . 0.0 112.496 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -74.5 -20.25 18.31 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.508 2.139 . . . . 0.0 112.425 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.43 179.41 7.81 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.048 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -91.28 -68.69 1.17 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.567 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.25 133.71 31.13 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-O 120.598 0.237 . . . . 0.0 110.906 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.13 -166.81 0.21 Allowed 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.441 2.094 . . . . 0.0 112.223 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.417 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.3 OUTLIER -81.1 122.92 27.94 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.964 -179.985 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.8 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 8.2 t -87.87 -28.85 21.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.372 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.466 ' HB2' ' OE1' ' A' ' 33' ' ' GLN . . . -59.43 -39.24 82.87 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 176.418 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 39.3 t -68.94 -33.1 73.17 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.454 176.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.8 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.2 mtm -64.13 -34.86 79.01 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.818 177.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.491 HD12 ' HB3' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -55.25 -49.96 70.69 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.329 178.684 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.05 -32.41 73.86 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.611 178.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.1 m -101.38 46.67 0.93 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.76 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.763 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -131.97 -39.84 0.03 OUTLIER Pre-proline 0 CA--C 1.537 0.447 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 -178.027 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.643 ' HA ' ' O ' ' A' ' 17' ' ' PRO . 92.2 Cg_exo -46.85 141.26 12.0 Favored 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 121.674 1.583 . . . . 0.0 112.038 -178.448 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.643 ' O ' ' HA ' ' A' ' 16' ' ' PRO . 16.7 Cg_exo -71.12 -140.49 0.16 OUTLIER 'Cis proline' 0 C--N 1.354 0.826 0 C-N-CA 124.498 -1.043 . . . . 0.0 114.209 3.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -52.85 77.64 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 -176.616 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.763 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 2.1 tp10 -106.59 13.83 27.77 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.879 175.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.512 ' O ' HD13 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -46.25 -56.31 5.95 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.672 -177.512 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.476 ' H ' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -56.02 -24.3 38.37 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.506 -178.342 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.464 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 17.1 tp60 -73.6 -78.45 0.09 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.908 0.385 . . . . 0.0 111.838 179.398 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.579 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -68.96 -97.29 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 112.997 0.74 . . . . 0.0 112.997 -175.93 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.579 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -57.03 0.34 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.275 0 N-CA-C 113.51 0.929 . . . . 0.0 113.51 -175.519 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.427 ' H ' ' C ' ' A' ' 23' ' ' MET . . . 64.79 -117.19 9.99 Favored Glycine 0 CA--C 1.505 -0.594 0 N-CA-C 108.269 -1.932 . . . . 0.0 108.269 -174.685 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.749 ' HG3' HD22 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -75.56 -68.27 0.58 Allowed 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 168.089 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.747 ' HE ' HD11 ' A' ' 59' ' ' LEU . 1.1 tpt180 -160.52 8.42 0.09 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.151 -1.386 . . . . 0.0 107.999 174.37 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.745 HD23 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.23 -73.96 0.08 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.551 -1.204 . . . . 0.0 113.896 -172.921 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.565 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.2 OUTLIER -36.79 -49.79 1.99 Allowed Pre-proline 0 CA--C 1.536 0.431 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -175.336 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.587 ' HG2' ' O ' ' A' ' 27' ' ' ARG . 12.4 Cg_endo -58.95 -41.69 59.41 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 121.975 1.783 . . . . 0.0 113.128 -178.053 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.739 HD11 ' HA ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -71.06 -45.44 63.79 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 120.339 -0.545 . . . . 0.0 110.182 -179.663 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.671 HG12 HG12 ' A' ' 69' ' ' VAL . 0.8 OUTLIER -71.56 -17.27 19.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.313 -0.403 . . . . 0.0 109.933 177.59 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.647 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 2.0 tt0 -63.26 -32.51 73.93 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 176.455 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.5 -29.64 65.04 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.679 -0.859 . . . . 0.0 108.679 175.02 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.545 ' HE3' HG11 ' A' ' 69' ' ' VAL . 8.9 mtt -100.08 19.67 15.91 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 114.84 -1.073 . . . . 0.0 109.72 177.242 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.647 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.6 OUTLIER -63.81 -34.8 13.25 Favored Pre-proline 0 CA--C 1.532 0.263 0 CA-C-N 115.511 -0.768 . . . . 0.0 112.106 -178.636 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.542 ' CD ' ' N ' ' A' ' 36' ' ' HIS . 87.4 Cg_exo -42.18 -26.22 0.5 Allowed 'Trans proline' 0 C--N 1.361 1.191 0 C-N-CA 121.769 1.646 . . . . 0.0 111.066 177.323 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.756 HG23 HG13 ' A' ' 73' ' ' VAL . 86.8 m -77.99 -80.95 0.1 Allowed 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.325 -0.852 . . . . 0.0 109.556 176.089 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.598 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -171.63 52.51 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 112.608 0.595 . . . . 0.0 112.608 178.61 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -56.86 149.51 18.33 Favored 'General case' 0 C--O 1.231 0.127 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 176.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.565 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . 132.57 -73.41 0.46 Allowed Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.566 -178.364 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.56 -28.17 51.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.698 0.285 . . . . 0.0 111.043 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.503 ' O ' HD22 ' A' ' 47' ' ' LEU . 55.2 mt -54.05 -53.77 25.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.795 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.745 ' HA ' HD23 ' A' ' 28' ' ' LEU . 13.1 t -54.25 -37.02 64.21 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.827 0.346 . . . . 0.0 110.538 178.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.839 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -48.12 -70.5 0.73 Allowed Glycine 0 N--CA 1.45 -0.418 0 CA-C-N 115.745 -0.661 . . . . 0.0 113.119 -179.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.629 ' HE1' HG23 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -55.36 -45.67 76.48 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -178.127 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.623 HD12 ' HB3' ' B' ' 6' ' ' LEU . 3.1 mm? -79.91 7.7 8.36 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -177.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.599 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.34 -7.38 18.6 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.881 0.372 . . . . 0.0 110.853 179.556 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.41 ' OE1' ' HG3' ' B' ' 11' ' ' LYS . 1.2 mm-40 -85.65 18.55 2.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.807 179.187 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.457 HG23 ' HG2' ' A' ' 26' ' ' GLU . 0.8 OUTLIER -83.72 162.63 3.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.861 -179.684 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.499 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 21.3 m-20 -70.96 157.58 37.95 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.902 0.382 . . . . 0.0 111.778 -178.506 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.551 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 3.1 m120 -87.07 -29.87 21.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.91 -0.587 . . . . 0.0 109.971 177.72 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.1 -30.51 62.37 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 177.094 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.499 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -78.38 -27.41 46.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.59 179.058 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.749 HD22 ' HG3' ' A' ' 26' ' ' GLU . 0.8 OUTLIER -61.6 -47.07 87.14 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.473 179.98 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 58.1 tp -61.9 -43.85 98.01 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.946 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -60.2 -28.48 68.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.443 -179.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.505 ' HE3' ' HE2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -68.39 -51.07 48.13 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.529 -179.076 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.747 HD11 ' HE ' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -63.58 -20.24 65.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.194 -179.303 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -95.53 -5.84 41.84 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.02 0.438 . . . . 0.0 110.496 178.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.618 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 5.1 m -122.69 79.46 48.27 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.631 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -55.29 -34.57 88.95 Favored 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 122.36 2.04 . . . . 0.0 112.178 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -78.41 -49.34 13.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.945 -179.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.525 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 15.7 m -69.2 -45.96 68.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.961 0.41 . . . . 0.0 111.39 -178.029 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.618 ' HB3' ' O ' ' A' ' 61' ' ' SER . 0.2 OUTLIER -59.46 -61.49 2.59 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.774 -178.558 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.618 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -50.78 -31.76 17.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.208 -177.538 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.516 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 20.7 t -63.86 -42.76 97.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.11 0.481 . . . . 0.0 110.276 178.346 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.505 ' HE2' ' HE3' ' A' ' 58' ' ' MET . 6.3 ttmm -66.31 -58.12 6.01 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.853 179.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.734 ' HA ' ' HB2' ' A' ' 72' ' ' ALA . 79.3 t -62.37 -20.78 25.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.616 179.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.516 ' HB3' ' O ' ' A' ' 67' ' ' SER . 9.6 t0 -54.71 -49.08 71.59 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 176.343 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.47 ' HG2' ' HB3' ' B' ' 5' ' ' ASN . 0.5 OUTLIER -68.88 -29.48 67.79 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.847 176.495 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.745 ' HA ' HG13 ' A' ' 75' ' ' VAL . . . -60.44 -38.01 82.74 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.087 178.068 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.756 HG13 HG23 ' A' ' 38' ' ' THR . 3.6 t -64.74 -29.35 47.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 176.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.15 -38.94 66.06 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.251 179.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.745 HG13 ' HA ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.07 -30.34 38.79 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-O 121.127 0.489 . . . . 0.0 110.086 179.343 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.598 ' HG ' ' HB3' ' A' ' 39' ' ' LEU . 3.0 tm? -71.19 -52.78 17.18 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.209 178.689 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -55.99 -34.52 65.85 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.614 179.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.42 ' O ' ' HB1' ' A' ' 81' ' ' ALA . . . -81.01 -23.04 38.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.787 179.045 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.593 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 19.3 t60 -70.23 -49.21 52.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.86 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.474 ' O ' ' HB1' ' A' ' 84' ' ' ALA . 4.0 mt-30 -71.48 -5.25 31.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.18 -179.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.42 ' HB1' ' O ' ' A' ' 78' ' ' ALA . . . -64.06 -66.89 0.48 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.962 179.768 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.4 -15.69 57.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.83 179.711 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.593 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 1.8 tm-20 -76.82 -26.04 53.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.029 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.474 ' HB1' ' O ' ' A' ' 80' ' ' GLN . . . -68.24 -16.75 64.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.126 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.35 -31.52 72.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.044 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -93.25 -30.7 15.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.942 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.4 ttmt -83.67 114.83 21.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.972 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -80.43 83.82 6.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.986 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -85.19 155.88 3.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.035 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -74.48 176.67 6.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.91 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.2 5.15 23.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.052 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -90.0 84.5 6.18 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.11 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 16.5 p -104.69 119.31 38.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.901 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -103.04 49.29 0.97 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.511 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.517 ' N ' ' HD2' ' A' ' 96' ' ' PRO . 11.4 t -81.37 -51.21 0.89 Allowed Pre-proline 0 C--N 1.329 -0.312 0 N-CA-C 111.553 0.205 . . . . 0.0 111.553 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.517 ' HD2' ' N ' ' A' ' 95' ' ' VAL . 39.3 Cg_endo -66.78 134.37 34.68 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 122.19 1.927 . . . . 0.0 112.238 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 32.4 p -89.14 40.18 0.97 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.01 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.5 HG21 ' HB2' ' A' ' 96' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.053 -0.975 . . . . 0.0 111.047 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 3.4 t . . . . . 0 N--CA 1.486 1.325 0 CA-C-O 120.764 0.316 . . . . 0.0 110.921 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 12.2 t -81.72 139.73 17.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.076 -179.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 5.8 mtpt -95.16 66.56 2.95 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.895 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' SER . . . . . 0.491 ' HB3' ' O ' ' B' ' 7' ' ' ASN . 8.4 t -89.67 -174.98 4.51 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.846 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' ASN . . . . . 0.47 ' HB3' ' HG2' ' A' ' 71' ' ' GLU . 1.8 m-80 -104.15 -57.35 2.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.923 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.623 ' HB3' HD12 ' A' ' 47' ' ' LEU . 0.2 OUTLIER -71.27 -84.52 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.685 179.806 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . 0.491 ' O ' ' HB3' ' B' ' 4' ' ' SER . 3.2 t30 -78.41 139.11 59.38 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.851 179.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -79.01 -9.21 15.5 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 122.328 2.018 . . . . 0.0 111.94 178.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 72.7 m-80 -123.31 57.79 1.14 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.79 179.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . 0.41 ' HB3' ' HB2' ' B' ' 4' ' ' SER . . . -59.76 93.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.603 -179.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.41 ' HG3' ' OE1' ' A' ' 49' ' ' GLU . 10.2 mttp -114.02 125.19 53.71 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.337 179.038 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -48.74 168.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -177.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 13' ' ' PHE . . . . . 0.839 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.5 OUTLIER -87.78 80.25 7.93 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.07 179.159 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . 0.502 HG22 ' HD3' ' B' ' 15' ' ' PRO . 1.3 m -116.34 -45.07 0.05 OUTLIER Pre-proline 0 CA--C 1.539 0.53 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -176.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 15' ' ' PRO . . . . . 0.502 ' HD3' HG22 ' B' ' 14' ' ' VAL . 80.9 Cg_exo -47.6 -40.02 30.05 Favored 'Trans proline' 0 C--N 1.354 0.854 0 C-N-CA 122.218 1.945 . . . . 0.0 112.872 -178.508 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . 0.408 ' O ' ' HD2' ' A' ' 21' ' ' LYS . . . 82.85 -26.95 4.0 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.339 -179.658 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 29.2 m -95.13 -172.06 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.516 0.198 . . . . 0.0 110.682 179.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.31 90.67 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.939 0.4 . . . . 0.0 110.674 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.41 ' CD1' ' HG2' ' B' ' 15' ' ' PRO . 0.3 OUTLIER -78.37 124.7 28.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.008 -179.427 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 93.72 40.6 4.64 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.408 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 33.5 t30 -97.22 -15.45 20.84 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.813 0.339 . . . . 0.0 110.998 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 29.7 mm . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.213 -0.899 . . . . 0.0 111.021 -179.972 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.401 ' HA2' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.489 2.231 0 CA-C-O 120.123 -0.265 . . . . 0.0 112.524 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.815 ' HB3' ' HG ' ' A' ' 7' ' ' LEU . 21.6 Cg_exo -65.64 80.61 0.25 Allowed 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.756 2.304 . . . . 0.0 112.268 -179.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -100.02 -67.18 0.86 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.926 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -107.3 -97.55 2.52 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.55 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.523 ' HB3' ' HD3' ' A' ' 6' ' ' PRO . 2.1 t -82.37 -50.73 0.79 Allowed Pre-proline 0 CA--C 1.533 0.322 0 N-CA-C 111.428 0.159 . . . . 0.0 111.428 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.523 ' HD3' ' HB3' ' A' ' 5' ' ' SER . 26.4 Cg_exo -63.45 86.13 0.13 Allowed 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.296 1.997 . . . . 0.0 112.296 -179.62 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.815 ' HG ' ' HB3' ' A' ' 2' ' ' PRO . 0.1 OUTLIER -100.85 -73.47 0.64 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.883 179.838 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.763 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 10.2 t -87.83 -33.2 18.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.223 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.452 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.48 -37.48 78.35 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 176.766 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.2 t -68.0 -34.73 77.08 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.739 177.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.763 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 12.0 mtm -64.21 -36.49 84.25 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.912 177.577 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.562 HD11 ' HB3' ' A' ' 24' ' ' LEU . 4.1 mp -52.15 -48.68 64.77 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.117 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.03 -30.89 71.5 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.022 178.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.514 ' HG ' ' HA ' ' A' ' 11' ' ' MET . 3.5 p -101.37 19.5 17.66 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.54 -178.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.555 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -135.36 119.56 13.25 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.21 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_exo -56.02 167.54 2.35 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.617 2.211 . . . . 0.0 112.051 179.491 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_exo -56.29 -38.19 95.53 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.454 2.102 . . . . 0.0 112.422 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -73.32 -11.42 60.49 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.129 -179.648 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.555 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.9 OUTLIER -85.79 12.44 9.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.83 -179.963 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.496 ' O ' HD11 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -52.18 -57.61 9.11 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.372 -179.77 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.524 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.9 -20.37 15.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.539 -178.608 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.539 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 5.0 tp60 -73.2 -79.46 0.08 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.873 0.368 . . . . 0.0 111.341 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.575 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.87 -94.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -176.682 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.575 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -60.88 1.94 0.13 Allowed 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 113.682 0.993 . . . . 0.0 113.682 -174.876 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.86 -117.01 9.63 Favored Glycine 0 N--CA 1.445 -0.759 0 N-CA-C 108.359 -1.896 . . . . 0.0 108.359 -174.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.797 ' HG3' HD23 ' A' ' 55' ' ' LEU . 0.3 OUTLIER -75.49 -68.51 0.56 Allowed 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 107.24 -1.392 . . . . 0.0 107.24 168.572 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.537 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 3.6 tpt85 -160.34 9.37 0.1 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.303 -1.317 . . . . 0.0 108.223 174.643 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.771 HD21 ' HA ' ' A' ' 44' ' ' THR . 0.3 OUTLIER -58.73 -72.89 0.09 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 114.407 -1.27 . . . . 0.0 113.893 -173.244 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.633 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -36.01 -49.0 1.57 Allowed Pre-proline 0 CA--C 1.539 0.546 0 N-CA-C 113.318 0.858 . . . . 0.0 113.318 -175.454 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.527 ' O ' ' HB3' ' A' ' 33' ' ' GLN . 51.4 Cg_exo -59.39 -42.12 51.86 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.39 2.06 . . . . 0.0 113.573 -178.72 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.739 HD11 HD23 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.52 -46.84 62.87 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 120.458 -0.497 . . . . 0.0 109.987 -178.627 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.782 HG12 HG11 ' A' ' 69' ' ' VAL . 0.3 OUTLIER -74.57 -12.95 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.589 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.056 177.913 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.663 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 1.1 tt0 -62.46 -39.19 92.58 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 176.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.85 -30.5 69.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.432 -0.804 . . . . 0.0 108.881 174.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.639 ' SD ' HG13 ' A' ' 69' ' ' VAL . 7.4 mtt -100.3 26.0 7.02 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.254 177.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.663 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.7 p-80 -64.98 -32.22 6.37 Favored Pre-proline 0 CA--C 1.536 0.418 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -177.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.59 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 42.8 Cg_exo -33.65 -35.47 0.08 OUTLIER 'Trans proline' 0 C--N 1.365 1.405 0 C-N-CA 122.288 1.992 . . . . 0.0 112.133 179.212 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.412 ' HB ' ' H ' ' A' ' 39' ' ' LEU . 2.7 m -78.1 -88.87 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.458 175.877 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.861 ' HB3' HD13 ' A' ' 76' ' ' LEU . 0.2 OUTLIER -171.79 66.6 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.723 -0.217 . . . . 0.0 111.399 177.668 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.5 ' HB1' ' O ' ' A' ' 32' ' ' ILE . . . -48.13 -32.67 7.21 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.565 179.561 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.633 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -46.41 -60.26 4.8 Favored Glycine 0 CA--C 1.518 0.256 0 CA-C-N 115.988 -0.551 . . . . 0.0 114.384 -178.283 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.873 ' HE3' ' HG3' ' B' ' 12' ' ' GLU . 4.4 tptm -77.27 -33.23 55.91 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.938 0.369 . . . . 0.0 111.943 -177.364 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.681 HD12 ' HA ' ' A' ' 73' ' ' VAL . 29.9 mt -54.01 -57.67 5.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.739 -0.21 . . . . 0.0 111.062 -179.212 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.771 ' HA ' HD21 ' A' ' 28' ' ' LEU . 9.3 t -50.16 -42.61 51.31 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.889 0.376 . . . . 0.0 110.244 178.58 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.868 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -49.35 -67.13 1.88 Allowed Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.681 -0.691 . . . . 0.0 113.296 -179.822 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.652 ' HE1' HG21 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -55.4 -47.26 76.16 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.74 0.27 . . . . 0.0 111.488 -178.157 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.732 HD11 ' HB3' ' B' ' 6' ' ' LEU . 3.0 mm? -79.87 6.07 12.1 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -178.538 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.569 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.94 -10.58 40.3 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.915 0.388 . . . . 0.0 110.507 179.836 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.425 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 1.6 mm-40 -82.37 21.36 0.95 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.232 177.458 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.494 HG21 ' HG2' ' A' ' 26' ' ' GLU . 0.4 OUTLIER -83.53 160.73 3.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.991 -179.377 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.47 ' HB2' ' HG3' ' A' ' 54' ' ' GLU . 0.9 OUTLIER -70.87 156.61 39.36 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.658 -178.835 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.559 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 4.6 m120 -85.85 -27.87 24.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.197 178.037 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.82 -34.32 64.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.153 0.501 . . . . 0.0 109.769 177.672 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.52 ' O ' ' HG2' ' A' ' 58' ' ' MET . 4.5 mt-10 -76.43 -29.22 56.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.79 179.187 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.797 HD23 ' HG3' ' A' ' 26' ' ' GLU . 0.7 OUTLIER -58.98 -45.92 89.39 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.959 0.409 . . . . 0.0 109.961 179.495 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.762 ' HA ' HD11 ' A' ' 59' ' ' LEU . 0.4 OUTLIER -60.25 -44.35 95.34 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.668 179.453 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -64.96 -13.68 58.05 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.057 179.626 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.669 ' SD ' ' HE2' ' A' ' 68' ' ' LYS . 31.7 mmt -76.29 -56.91 4.21 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.466 -179.691 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.783 ' H ' HD12 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -67.1 -8.57 31.69 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 121.105 0.479 . . . . 0.0 110.429 178.927 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.528 ' O ' ' HG3' ' A' ' 60' ' ' GLU . 1.1 tp10 -98.61 -16.42 19.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.502 179.188 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.504 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 1.2 t -122.71 87.97 49.94 Favored Pre-proline 0 C--N 1.332 -0.153 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.373 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -60.22 -31.57 93.24 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.345 2.03 . . . . 0.0 111.89 179.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.458 ' O ' ' HB2' ' A' ' 67' ' ' SER . 6.9 mm-40 -77.87 -50.34 12.45 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.475 -179.693 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 67.8 m -69.38 -53.31 20.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.444 -178.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.739 HD23 HD11 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -57.99 -62.56 1.72 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.645 -178.177 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.456 ' HG2' ' CE ' ' A' ' 35' ' ' MET . 0.0 OUTLIER -49.93 -35.68 24.83 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.022 -177.639 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.49 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.2 OUTLIER -69.59 -36.14 75.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.159 0.504 . . . . 0.0 110.048 178.046 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.669 ' HE2' ' SD ' ' A' ' 58' ' ' MET . 0.1 OUTLIER -66.4 -53.88 30.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.659 179.248 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.782 HG11 HG12 ' A' ' 32' ' ' ILE . 40.0 t -68.05 -19.08 24.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.317 178.537 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.629 ' O ' HG22 ' A' ' 73' ' ' VAL . 19.4 t0 -55.68 -48.75 74.54 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 176.596 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.475 ' O ' HG13 ' A' ' 75' ' ' VAL . 1.2 tp10 -69.05 -26.34 64.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.739 176.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.714 ' HB2' ' HA ' ' A' ' 69' ' ' VAL . . . -60.78 -47.94 84.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.924 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.681 ' HA ' HD12 ' A' ' 43' ' ' ILE . 4.9 m -60.2 -28.33 41.41 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.156 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 177.108 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.433 ' O ' ' HG3' ' A' ' 77' ' ' GLN . . . -71.43 -30.26 65.85 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.133 178.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.686 HG12 ' HA ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -69.12 -36.16 71.99 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 CA-C-O 120.812 0.339 . . . . 0.0 110.476 179.592 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.861 HD13 ' HB3' ' A' ' 39' ' ' LEU . 0.2 OUTLIER -71.73 -56.32 6.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.939 179.782 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.433 ' HG3' ' O ' ' A' ' 74' ' ' ALA . 0.0 OUTLIER -52.41 -36.66 54.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.134 0.492 . . . . 0.0 110.332 179.794 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.402 ' O ' ' HB2' ' A' ' 81' ' ' ALA . . . -80.8 -24.38 38.58 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.756 178.453 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.571 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 77.2 t60 -65.15 -55.61 17.65 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.727 179.605 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.432 ' O ' ' HB2' ' A' ' 84' ' ' ALA . 1.7 mt-30 -78.86 2.47 19.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.008 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.402 ' HB2' ' O ' ' A' ' 78' ' ' ALA . . . -70.85 -71.62 0.24 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.207 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.12 -13.81 59.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.258 -179.428 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.571 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 0.3 OUTLIER -76.09 -40.05 53.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.953 -179.892 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.432 ' HB2' ' O ' ' A' ' 80' ' ' GLN . . . -63.77 -36.44 83.87 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.972 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -84.07 -6.69 59.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.862 179.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.61 -58.43 2.58 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.886 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -77.41 -61.46 1.98 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.98 -179.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -88.43 86.75 7.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.197 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.1 t -85.94 63.94 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.909 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 58.2 m-20 -80.37 138.35 36.67 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.95 -179.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.99 -66.83 0.89 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.911 179.847 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -83.25 142.41 31.15 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.033 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -103.69 168.33 9.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.912 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -99.74 85.49 0.65 Allowed Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.388 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.3 p -92.43 124.61 58.81 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 120.728 0.299 . . . . 0.0 111.039 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -89.77 -66.21 0.01 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.707 0 C-N-CA 122.856 2.371 . . . . 0.0 112.757 -179.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.91 174.24 9.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.94 -179.676 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 12.0 p . . . . . 0 C--O 1.249 1.054 0 CA-C-O 117.914 -1.041 . . . . 0.0 111.089 179.926 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.803 0.335 . . . . 0.0 111.007 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.4 p -94.46 153.58 3.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.019 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.54 77.39 2.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.918 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' SER . . . . . 0.415 ' HB2' ' O ' ' B' ' 7' ' ' ASN . 0.0 OUTLIER -82.43 172.06 13.47 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.841 -179.877 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 49.1 m-80 -107.02 -67.27 0.96 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.32 -179.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.732 ' HB3' HD11 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -62.57 -73.34 0.11 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.006 -179.394 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . 0.61 ' HB2' HD13 ' A' ' 47' ' ' LEU . 1.4 t30 -90.5 128.78 47.48 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.186 -179.636 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -77.79 -1.07 11.25 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.259 1.972 . . . . 0.0 111.798 178.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' ASN . . . . . 0.559 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 26.6 m120 -123.41 52.12 1.43 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.682 179.749 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . 0.643 ' HB2' ' HB3' ' A' ' 46' ' ' MET . . . -60.41 98.25 0.06 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.892 -179.553 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.559 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 2.7 mmtm -121.97 141.32 51.44 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.54 178.344 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . 0.873 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 17.2 mp0 -50.24 162.4 0.22 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.948 0.404 . . . . 0.0 111.999 -179.058 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 13' ' ' PHE . . . . . 0.868 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.9 OUTLIER -88.09 82.87 7.07 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.614 177.809 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . 0.555 HG21 ' HD3' ' B' ' 15' ' ' PRO . 1.2 m -127.89 -34.81 0.04 OUTLIER Pre-proline 0 CA--C 1.539 0.52 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 -175.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 15' ' ' PRO . . . . . 0.555 ' HD3' HG21 ' B' ' 14' ' ' VAL . 99.7 Cg_exo -45.01 -33.42 7.69 Favored 'Trans proline' 0 C--N 1.357 1.004 0 C-N-CA 121.832 1.688 . . . . 0.0 112.777 -179.073 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.33 -33.43 2.02 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.468 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.452 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 1.6 m -94.85 -175.19 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.688 0.28 . . . . 0.0 110.648 179.548 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.9 96.25 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.808 -179.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.449 ' CG ' ' HG2' ' B' ' 15' ' ' PRO . 0.6 OUTLIER -80.9 100.48 8.9 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.983 -179.494 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 74.32 76.69 0.7 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.351 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . 0.498 ' ND2' HG12 ' B' ' 22' ' ' ILE . 0.4 OUTLIER -100.16 -37.95 8.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.95 0.405 . . . . 0.0 111.105 -179.566 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . 0.498 HG12 ' ND2' ' B' ' 21' ' ' ASN . 19.2 pt . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.184 -0.912 . . . . 0.0 111.203 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.24 0 N-CA-C 112.489 -0.244 . . . . 0.0 112.489 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_exo -56.98 -58.74 0.81 Allowed 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.535 2.156 . . . . 0.0 112.246 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -77.99 119.13 21.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.973 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -97.1 -23.37 14.99 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.571 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.41 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 0.3 OUTLIER -89.08 140.78 29.03 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-O 120.58 0.228 . . . . 0.0 110.893 179.909 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 5' ' ' SER . 35.3 Cg_exo -60.0 146.2 96.54 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.513 2.142 . . . . 0.0 112.223 -179.77 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.445 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.0 OUTLIER -86.65 127.23 34.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.814 179.792 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.771 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 8.9 t -87.9 -29.36 20.92 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.503 -179.623 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.32 -39.4 82.97 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 176.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 10.9 t -69.69 -33.63 72.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.763 177.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.771 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.4 mtm -64.29 -37.04 86.08 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 116.169 -0.469 . . . . 0.0 109.888 177.726 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.744 HD12 ' HB3' ' A' ' 24' ' ' LEU . 1.4 mp -52.0 -51.83 54.66 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.205 179.125 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.22 -31.92 73.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.441 178.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.57 23.61 10.93 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.343 -0.39 . . . . 0.0 112.002 -178.137 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.638 ' HB3' ' HB3' ' A' ' 19' ' ' GLU . . . -138.15 118.4 10.07 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 120.555 0.217 . . . . 0.0 111.285 179.582 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.43 168.96 1.25 Allowed 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.511 2.141 . . . . 0.0 111.961 179.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.81 -33.73 98.65 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.31 2.007 . . . . 0.0 112.299 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -73.41 -9.53 58.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.031 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.667 ' HG3' ' HB3' ' A' ' 22' ' ' GLN . 5.8 tp10 -89.68 11.35 20.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.074 -179.536 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.424 ' NE2' ' HG2' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -52.05 -58.36 6.76 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.387 -179.908 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.563 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.93 -21.81 22.67 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.543 -178.242 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.667 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 20.8 tp60 -73.39 -80.27 0.07 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.992 0.425 . . . . 0.0 111.654 179.683 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.622 ' HE2' ' HB1' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -69.62 -94.94 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -176.7 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.744 ' HB3' HD12 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -59.96 -1.34 0.28 Allowed 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 -174.819 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.576 ' O ' HD23 ' A' ' 24' ' ' LEU . . . 65.06 -116.93 9.47 Favored Glycine 0 N--CA 1.446 -0.648 0 N-CA-C 108.501 -1.84 . . . . 0.0 108.501 -174.54 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.635 ' HG3' HD21 ' A' ' 55' ' ' LEU . 0.7 OUTLIER -76.2 -67.23 0.7 Allowed 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 169.592 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.67 ' HD3' HD13 ' A' ' 24' ' ' LEU . 6.5 tpt180 -159.65 7.06 0.1 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.247 -1.342 . . . . 0.0 108.06 175.878 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.84 ' HA ' HD13 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -59.19 -78.06 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.441 -1.254 . . . . 0.0 114.26 -172.906 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.602 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -32.88 -48.84 0.58 Allowed Pre-proline 0 CA--C 1.541 0.601 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -175.099 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.579 ' CD ' ' HB2' ' A' ' 24' ' ' LEU . 20.1 Cg_endo -63.44 -39.33 37.31 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.336 2.024 . . . . 0.0 113.817 -178.107 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.84 HD13 ' HA ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -70.44 -45.48 65.72 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 119.997 -0.681 . . . . 0.0 109.506 179.981 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.731 HG12 HG12 ' A' ' 69' ' ' VAL . 0.4 OUTLIER -73.46 -13.29 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.688 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.698 177.46 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.647 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -62.52 -38.1 88.63 Favored 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 177.213 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.41 -28.98 65.49 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 174.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.555 ' SD ' HG11 ' A' ' 69' ' ' VAL . 7.8 mtt -100.16 25.61 7.32 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.087 177.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.647 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -64.62 -31.49 5.75 Favored Pre-proline 0 CA--C 1.536 0.422 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 -177.471 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.586 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 35.7 Cg_exo -33.31 -34.98 0.07 OUTLIER 'Trans proline' 0 C--N 1.364 1.352 0 C-N-CA 122.339 2.026 . . . . 0.0 112.034 178.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.426 ' N ' ' O ' ' A' ' 36' ' ' HIS . 0.2 OUTLIER -78.01 -90.99 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 175.383 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.825 ' HB3' HD13 ' A' ' 76' ' ' LEU . 0.1 OUTLIER -171.88 67.07 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.649 -0.251 . . . . 0.0 111.307 177.163 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.48 ' CB ' ' HB ' ' A' ' 32' ' ' ILE . . . -46.38 -28.74 1.43 Allowed 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.922 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.602 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -50.45 -62.08 5.43 Favored Glycine 0 CA--C 1.518 0.27 0 CA-C-N 116.172 -0.467 . . . . 0.0 113.941 -178.375 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.59 ' HB3' HD11 ' A' ' 76' ' ' LEU . 4.6 tptm -74.95 -33.71 61.96 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.021 0.378 . . . . 0.0 112.021 -177.299 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.603 HD13 ' HA ' ' A' ' 73' ' ' VAL . 30.5 mt -54.36 -57.37 6.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.432 -178.711 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.738 ' HA ' HD21 ' A' ' 28' ' ' LEU . 9.0 t -51.2 -45.52 61.88 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.898 0.38 . . . . 0.0 110.519 178.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.6 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -49.66 -64.8 3.2 Favored Glycine 0 N--CA 1.451 -0.311 0 CA-C-N 115.689 -0.687 . . . . 0.0 113.282 -179.452 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.493 ' SD ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.64 -47.57 76.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.83 0.315 . . . . 0.0 111.79 -178.374 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.727 HD11 ' HB2' ' B' ' 6' ' ' LEU . 3.5 mm? -80.18 6.58 11.35 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.649 0.24 . . . . 0.0 111.649 -178.733 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.6 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.17 -7.01 15.4 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.989 0.423 . . . . 0.0 110.77 179.897 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.435 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 3.2 mt-10 -81.67 16.85 1.61 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.295 177.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.492 HD12 ' HE3' ' A' ' 68' ' ' LYS . 1.0 OUTLIER -83.1 160.78 3.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.112 -179.187 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.447 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 1.5 m-20 -71.11 158.17 36.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.805 -178.765 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.476 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 3.9 m120 -86.69 -28.97 22.8 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.841 177.431 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.75 -32.62 63.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.37 0.605 . . . . 0.0 109.519 177.08 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.452 ' OE2' HD12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -75.7 -28.59 58.66 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.564 179.168 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.635 HD21 ' HG3' ' A' ' 26' ' ' GLU . 0.6 OUTLIER -60.52 -47.22 87.12 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.002 0.429 . . . . 0.0 110.348 179.533 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.425 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 52.1 tp -58.1 -43.69 87.23 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.555 179.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.463 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 1.7 t-80 -59.37 -41.29 88.98 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.67 179.122 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.524 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -61.21 -38.68 87.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.353 178.933 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.3 tt -68.11 -20.36 64.92 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.349 178.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.463 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 2.2 pt-20 -107.02 -2.62 20.92 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.458 -179.274 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.572 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 15.9 m -122.52 88.37 49.42 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.251 -178.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -62.19 -31.96 82.72 Favored 'Trans proline' 0 C--N 1.343 0.258 0 C-N-CA 122.1 1.867 . . . . 0.0 111.688 178.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.546 ' O ' ' HB2' ' A' ' 67' ' ' SER . 5.0 mt-10 -78.45 -50.44 11.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.765 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.9 t -69.17 -52.38 28.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.082 0.468 . . . . 0.0 111.424 -178.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.616 HD13 ' N ' ' A' ' 66' ' ' ARG . 0.2 OUTLIER -58.13 -64.3 0.96 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.62 -177.882 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.616 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -51.13 -35.04 33.6 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.195 -177.553 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.546 ' HB2' ' O ' ' A' ' 63' ' ' GLU . 0.2 OUTLIER -69.7 -36.41 75.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.9 0.381 . . . . 0.0 110.315 178.428 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.492 ' HE3' HD12 ' A' ' 50' ' ' ILE . 0.9 OUTLIER -66.32 -56.45 11.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.318 179.005 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.758 ' HA ' ' HB1' ' A' ' 72' ' ' ALA . 45.3 t -64.56 -21.07 28.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.492 179.039 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.581 ' O ' HG23 ' A' ' 73' ' ' VAL . 26.7 t70 -56.35 -48.4 76.87 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 176.713 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.41 ' O ' ' HB2' ' A' ' 74' ' ' ALA . 0.8 OUTLIER -68.9 -26.76 65.26 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.751 176.449 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.758 ' HB1' ' HA ' ' A' ' 69' ' ' VAL . . . -60.58 -46.62 89.54 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.527 -0.761 . . . . 0.0 111.07 179.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.603 ' HA ' HD13 ' A' ' 43' ' ' ILE . 3.6 m -61.24 -29.5 45.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 177.392 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.459 ' O ' ' HG3' ' A' ' 77' ' ' GLN . . . -70.32 -28.41 65.14 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.151 179.248 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.606 HG13 ' HA ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -69.87 -36.58 70.06 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.171 0 CA-C-O 120.811 0.338 . . . . 0.0 110.571 179.544 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.825 HD13 ' HB3' ' A' ' 39' ' ' LEU . 0.2 OUTLIER -71.49 -53.99 12.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.134 -179.917 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.459 ' HG3' ' O ' ' A' ' 74' ' ' ALA . 0.0 OUTLIER -52.58 -37.97 59.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.272 0.558 . . . . 0.0 110.283 -179.965 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.11 -21.9 42.73 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.762 178.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.513 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 31.7 t60 -70.69 -54.98 9.79 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.133 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -67.68 -5.1 14.26 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.416 -179.301 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -71.59 -65.85 0.7 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.262 -179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.2 -4.17 52.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.369 -179.631 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.513 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 0.1 OUTLIER -84.78 -48.31 9.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.11 -179.74 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -72.57 -2.79 21.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.191 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.18 -45.13 89.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.979 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -89.07 103.45 16.06 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.861 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 11.7 mtmm -94.08 25.9 3.52 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.887 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -87.52 67.07 9.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.165 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.0 p -101.68 84.78 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.206 0.527 . . . . 0.0 110.899 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -104.65 12.41 32.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.934 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.13 0.43 56.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.035 -179.713 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.28 -167.91 0.86 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.075 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 1.4 p -113.67 -166.75 1.12 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.01 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -77.19 -100.44 0.17 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.833 -0.698 . . . . 0.0 112.623 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 3.2 t -83.75 110.14 23.14 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-O 120.593 0.235 . . . . 0.0 111.181 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -75.84 73.74 4.68 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.901 2.401 . . . . 0.0 112.221 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -103.05 95.72 6.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.844 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.0 m . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.043 -0.979 . . . . 0.0 111.22 -179.651 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 29.0 m . . . . . 0 N--CA 1.487 1.403 0 CA-C-O 120.786 0.327 . . . . 0.0 110.893 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 11.9 p -96.08 151.43 4.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.224 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . 0.419 ' HB3' ' H ' ' B' ' 4' ' ' SER . 24.8 mttm -77.39 -143.16 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.041 178.036 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' SER . . . . . 0.425 ' HB3' ' O ' ' B' ' 7' ' ' ASN . 6.0 t -79.7 -177.11 5.72 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.824 0.345 . . . . 0.0 111.208 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -103.87 -49.53 3.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.706 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.727 ' HB2' HD11 ' A' ' 47' ' ' LEU . 7.9 mt -66.7 -69.11 0.33 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.459 179.137 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . 0.523 ' HB2' HD13 ' A' ' 47' ' ' LEU . 1.2 t30 -94.68 129.38 36.46 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.961 179.115 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 3.6 Cg_exo -76.49 -4.8 15.46 Favored 'Trans proline' 0 N--CA 1.462 -0.358 0 C-N-CA 122.563 2.175 . . . . 0.0 112.344 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' ASN . . . . . 0.435 ' H ' HD21 ' B' ' 7' ' ' ASN . 72.2 m-20 -123.61 48.7 1.82 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.986 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.44 97.19 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.616 -179.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.516 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -122.71 134.07 54.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.039 178.975 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . 0.58 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 11.5 tt0 -49.17 173.22 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -177.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 13' ' ' PHE . . . . . 0.503 ' CE1' ' HG ' ' A' ' 48' ' ' LEU . 0.2 OUTLIER -86.94 77.12 9.28 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.712 179.005 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . 0.721 ' H ' ' HD2' ' B' ' 15' ' ' PRO . 0.9 OUTLIER -109.5 -37.87 0.13 Allowed Pre-proline 0 C--N 1.323 -0.571 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.331 -176.303 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 15' ' ' PRO . . . . . 0.721 ' HD2' ' H ' ' B' ' 14' ' ' VAL . 11.7 Cg_endo -54.82 -45.74 38.67 Favored 'Trans proline' 0 C--N 1.356 0.923 0 C-N-CA 121.948 1.766 . . . . 0.0 112.552 -178.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 83.69 -26.27 4.77 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.254 -179.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.544 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 1.9 p -94.88 -175.51 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 110.433 -0.21 . . . . 0.0 110.433 179.437 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.424 ' HG2' ' NE2' ' A' ' 20' ' ' GLN . 15.9 mttt -59.66 89.84 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.85 0.357 . . . . 0.0 110.857 -179.598 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.516 ' CE2' ' HG2' ' B' ' 11' ' ' LYS . 1.1 t80 -85.53 120.94 27.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.994 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 89.59 30.98 12.01 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.228 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 59.5 t30 -94.0 161.9 14.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.653 0.263 . . . . 0.0 110.922 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 2.8 tp . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.251 -0.881 . . . . 0.0 111.05 -179.972 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.217 0 N-CA-C 112.518 -0.233 . . . . 0.0 112.518 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.538 ' HA ' ' HG3' ' A' ' 6' ' ' PRO . 49.6 Cg_exo -55.79 108.38 0.32 Allowed 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.63 2.22 . . . . 0.0 112.294 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.7 tp -75.62 -69.25 0.5 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.905 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -91.46 -98.37 1.27 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.422 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.599 ' N ' ' HA ' ' A' ' 6' ' ' PRO . 1.7 t -82.58 -41.03 0.9 Allowed Pre-proline 0 CA--C 1.538 0.495 0 N-CA-C 111.892 0.33 . . . . 0.0 111.892 179.771 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.599 ' HA ' ' N ' ' A' ' 5' ' ' SER . 8.3 Cg_exo -71.41 149.06 91.46 Favored 'Cis proline' 0 C--N 1.359 1.099 0 CA-C-N 119.627 0.902 . . . . 0.0 112.565 -1.79 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.485 ' HB3' ' NE2' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -89.76 170.59 10.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.816 179.967 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.78 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 15.0 t -88.21 -30.29 19.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.399 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.445 ' N ' HG22 ' A' ' 8' ' ' THR . . . -59.24 -35.65 74.04 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 176.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 40.7 t -72.91 -34.29 66.52 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.894 177.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.78 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 10.6 mtm -64.15 -35.86 82.17 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.804 177.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.635 HD13 ' HB3' ' A' ' 24' ' ' LEU . 5.6 mp -52.9 -55.63 21.83 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.995 178.273 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.9 -24.73 66.9 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.686 178.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.7 m -101.52 25.07 8.82 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.477 -179.222 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.578 ' HB2' ' HB2' ' A' ' 19' ' ' GLU . . . -134.07 61.66 52.46 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.889 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.546 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 51.0 Cg_exo -53.99 -49.94 15.37 Favored 'Trans proline' 0 CA--C 1.536 0.59 0 C-N-CA 122.781 2.321 . . . . 0.0 113.698 -178.438 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.546 ' HD3' ' HB2' ' A' ' 16' ' ' PRO . 16.7 Cg_exo -67.19 -167.62 0.15 Allowed 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 122.061 1.841 . . . . 0.0 112.076 -179.423 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -74.36 60.11 0.83 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.744 178.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.578 ' HB2' ' HB2' ' A' ' 15' ' ' ALA . 2.8 mm-40 -89.56 9.41 26.8 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.015 -179.16 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.496 ' O ' HD12 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -46.35 -64.51 0.74 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.894 0.378 . . . . 0.0 110.997 -179.039 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.602 ' HD2' ' HA ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER -56.49 -23.14 37.31 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.313 -179.512 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.493 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 2.7 tp60 -73.47 -75.98 0.14 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.771 0.32 . . . . 0.0 111.538 179.555 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.606 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -68.99 -96.58 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 112.613 0.598 . . . . 0.0 112.613 -176.332 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.635 ' HB3' HD13 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -62.13 3.08 0.19 Allowed 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -175.309 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.49 -117.28 10.29 Favored Glycine 0 N--CA 1.445 -0.761 0 N-CA-C 108.258 -1.937 . . . . 0.0 108.258 -174.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.649 ' HG3' HD23 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -75.49 -69.34 0.49 Allowed 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 168.609 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.755 ' HB2' HD11 ' A' ' 55' ' ' LEU . 9.9 tpt85 -160.44 10.08 0.1 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.188 -1.369 . . . . 0.0 107.768 174.164 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.823 HD23 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.09 -71.62 0.12 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 114.549 -1.205 . . . . 0.0 113.728 -173.14 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.625 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -36.28 -48.92 1.69 Allowed Pre-proline 0 CA--C 1.54 0.583 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -176.24 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.633 ' HB2' ' NH1' ' A' ' 27' ' ' ARG . 42.6 Cg_exo -61.4 -41.12 43.35 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 122.511 2.141 . . . . 0.0 113.874 -178.174 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.785 HD11 ' HA ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -69.98 -45.94 66.25 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.359 0.6 . . . . 0.0 109.556 -179.094 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.737 HD12 ' HB ' ' A' ' 43' ' ' ILE . 0.7 OUTLIER -75.96 -12.09 14.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.021 177.381 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.634 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 3.5 tp-100 -62.44 -38.86 91.4 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.315 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.76 -31.22 70.11 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 174.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.488 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 5.7 mtt -100.23 27.35 5.72 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.261 178.121 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.634 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -64.92 -32.71 7.04 Favored Pre-proline 0 CA--C 1.536 0.405 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -177.171 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.54 ' CD ' ' N ' ' A' ' 36' ' ' HIS . 61.5 Cg_exo -37.12 -30.39 0.11 Allowed 'Trans proline' 0 C--N 1.36 1.178 0 C-N-CA 122.187 1.925 . . . . 0.0 112.36 179.618 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.524 ' OG1' HG12 ' A' ' 73' ' ' VAL . 37.2 m -78.65 -84.62 0.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.183 177.42 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.657 ' HB3' HD12 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -171.12 49.84 0.03 OUTLIER 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.39 179.219 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.473 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -38.23 -38.11 0.33 Allowed 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.378 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.625 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -51.29 -55.49 19.11 Favored Glycine 0 CA--C 1.518 0.226 0 C-N-CA 121.248 -0.501 . . . . 0.0 113.789 -179.185 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.641 ' HE3' ' HG3' ' B' ' 12' ' ' GLU . 3.5 tptm -77.18 -32.21 55.94 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -177.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.737 ' HB ' HD12 ' A' ' 32' ' ' ILE . 0.5 OUTLIER -54.96 -56.55 10.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.121 -179.255 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.823 ' HA ' HD23 ' A' ' 28' ' ' LEU . 11.8 t -51.37 -44.52 62.13 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.616 179.566 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.75 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -48.63 -68.86 1.13 Allowed Glycine 0 C--O 1.227 -0.297 0 CA-C-N 115.917 -0.583 . . . . 0.0 113.321 -179.376 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.596 ' SD ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.41 -46.76 76.61 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -178.192 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.557 HD11 ' HB2' ' B' ' 7' ' ' ASN . 3.4 mm? -80.31 7.93 8.53 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -178.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.614 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.94 -13.97 60.71 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.86 0.362 . . . . 0.0 110.767 179.894 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.536 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.0 mt-10 -78.6 19.18 0.5 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.731 178.629 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.739 HD13 ' NZ ' ' A' ' 68' ' ' LYS . 1.2 tt -83.22 163.97 2.84 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.982 -179.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.469 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 1.8 m-20 -71.25 156.37 39.62 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.836 -179.108 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.456 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 3.2 m120 -87.12 -28.21 22.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.75 176.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.7 m -74.14 -30.99 62.55 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 176.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.469 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.6 OUTLIER -75.4 -31.17 60.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.31 178.926 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.755 HD11 ' HB2' ' A' ' 27' ' ' ARG . 0.5 OUTLIER -59.28 -45.98 89.77 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.404 179.845 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.447 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 38.6 tp -58.8 -44.24 90.72 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.817 179.438 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.448 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 4.6 m80 -65.04 -38.73 91.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.126 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.801 ' HE1' ' HD3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -60.62 -38.02 83.34 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.101 0.477 . . . . 0.0 110.14 178.828 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.482 HD11 ' NE ' ' A' ' 27' ' ' ARG . 7.6 tt -69.61 -20.25 63.63 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.411 178.837 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.448 ' HG2' ' O ' ' A' ' 57' ' ' HIS . 4.3 pt-20 -106.91 -1.45 22.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.517 -179.34 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.589 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 5.9 m -122.95 78.91 50.52 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.223 -179.556 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.43 ' O ' ' HB2' ' A' ' 66' ' ' ARG . 50.5 Cg_exo -55.69 -33.19 86.67 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.243 1.962 . . . . 0.0 111.993 179.408 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -78.21 -50.39 12.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.824 -179.363 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.589 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 50.2 m -70.43 -51.35 30.04 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.92 0.391 . . . . 0.0 111.535 -177.793 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.67 ' HG ' HD21 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -57.81 -59.33 5.39 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.282 -178.658 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.591 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -52.51 -30.46 30.41 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.796 -178.379 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.524 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.4 OUTLIER -69.44 -38.33 77.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.106 0.479 . . . . 0.0 110.134 178.005 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.801 ' HD3' ' HE1' ' A' ' 58' ' ' MET . 5.7 mtpp -65.65 -59.01 4.38 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.287 178.661 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.755 ' HA ' ' HB1' ' A' ' 72' ' ' ALA . 52.8 t -61.73 -21.53 26.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.606 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.524 ' HB3' ' O ' ' A' ' 67' ' ' SER . 16.2 t70 -54.79 -49.45 70.93 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.416 ' O ' ' HB2' ' A' ' 74' ' ' ALA . 1.1 tp10 -68.84 -30.51 69.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.766 176.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.755 ' HB1' ' HA ' ' A' ' 69' ' ' VAL . . . -57.7 -40.57 79.82 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.105 177.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.524 HG12 ' OG1' ' A' ' 38' ' ' THR . 33.4 t -62.21 -31.11 50.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.526 176.759 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.416 ' HB2' ' O ' ' A' ' 71' ' ' GLU . . . -73.3 -37.14 66.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.53 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.712 HG11 ' HA ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -58.71 -28.17 36.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.963 0.411 . . . . 0.0 110.159 179.782 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.657 HD12 ' HB3' ' A' ' 39' ' ' LEU . 3.1 mm? -71.35 -53.72 13.2 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.876 178.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 20.8 mm100 -51.16 -35.44 35.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.372 179.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.56 -26.92 34.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.877 178.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.557 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 6.3 t60 -64.59 -50.4 67.36 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.162 -179.514 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -77.08 1.0 19.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.185 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -75.48 -65.14 0.93 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.099 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 9.5 mmtt -80.06 -4.62 53.48 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.168 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.557 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 1.0 OUTLIER -88.88 -42.09 12.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.036 -179.844 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.32 -30.21 71.03 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.049 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.51 -41.98 83.54 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.101 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 19.8 mm100 -82.7 174.42 11.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.873 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -77.56 160.34 28.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.893 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -78.98 75.25 5.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.943 179.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -91.09 106.16 17.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.011 -179.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -92.98 174.61 7.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.787 179.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 4.3 m -88.76 113.73 24.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.924 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -86.65 65.24 8.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.025 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 12.7 p -110.66 -75.03 0.63 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.839 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -106.01 102.42 1.95 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.351 179.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 3.2 t -107.95 91.6 7.96 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 120.637 0.256 . . . . 0.0 111.219 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -75.93 -4.21 14.87 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.594 2.196 . . . . 0.0 112.252 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.74 -73.3 0.39 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.022 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.5 t . . . . . 0 C--O 1.249 1.072 0 CA-C-O 117.946 -1.026 . . . . 0.0 111.064 -179.943 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 2.4 p . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 121.08 0.466 . . . . 0.0 110.951 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -99.77 171.26 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.996 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . 0.434 ' H ' ' HG2' ' B' ' 3' ' ' LYS . 0.0 OUTLIER -95.41 42.05 1.09 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.937 179.902 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -73.37 153.11 40.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.018 -179.909 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 27.5 m-20 -107.7 -60.64 1.68 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.816 179.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.18 -85.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.827 179.769 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . 0.557 ' HB2' HD11 ' A' ' 47' ' ' LEU . 1.5 t30 -74.46 124.29 89.72 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.816 179.571 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -76.59 -0.74 10.77 Favored 'Trans proline' 0 N--CA 1.463 -0.316 0 C-N-CA 122.138 1.892 . . . . 0.0 111.81 179.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -123.12 51.15 1.47 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.57 179.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.06 97.91 0.05 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.627 -179.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.536 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 2.8 mttp -122.85 138.09 54.75 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.498 178.817 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . 0.641 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 4.9 mp0 -48.43 166.03 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.026 0.441 . . . . 0.0 112.13 -178.841 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 13' ' ' PHE . . . . . 0.75 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.8 OUTLIER -87.74 86.41 7.17 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.87 -0.604 . . . . 0.0 109.699 178.726 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . 0.668 HG21 ' HD3' ' B' ' 15' ' ' PRO . 0.8 OUTLIER -129.56 -36.2 0.03 OUTLIER Pre-proline 0 CA--C 1.541 0.599 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -175.755 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 15' ' ' PRO . . . . . 0.668 ' HD3' HG21 ' B' ' 14' ' ' VAL . 90.4 Cg_exo -45.97 -33.3 10.85 Favored 'Trans proline' 0 C--N 1.357 1.002 0 C-N-CA 121.868 1.712 . . . . 0.0 112.746 -178.809 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . 0.51 ' O ' ' HD2' ' A' ' 21' ' ' LYS . . . 80.45 -34.42 2.25 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.462 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.602 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 11.8 m -94.77 -174.67 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.631 0.253 . . . . 0.0 110.743 179.562 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.71 95.13 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.93 0.395 . . . . 0.0 110.775 -179.662 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.5 ' CG ' ' HG2' ' B' ' 15' ' ' PRO . 0.7 OUTLIER -79.1 124.38 28.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.023 -179.28 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 86.5 63.06 1.5 Allowed Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.304 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -98.81 -19.54 17.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.781 0.324 . . . . 0.0 111.087 -179.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 9.5 mt . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.271 -0.871 . . . . 0.0 111.044 -179.951 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.17 0 N-CA-C 112.478 -0.249 . . . . 0.0 112.478 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -72.97 132.77 18.77 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.517 2.145 . . . . 0.0 112.35 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -94.15 84.8 4.52 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.914 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -107.05 10.43 40.25 Favored Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.357 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.629 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 5.8 t -86.46 -48.99 0.51 Allowed Pre-proline 0 CA--C 1.533 0.32 0 N-CA-C 111.595 0.22 . . . . 0.0 111.595 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.629 ' HD2' ' N ' ' A' ' 5' ' ' SER . 13.2 Cg_endo -56.3 -22.77 42.71 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 122.354 2.036 . . . . 0.0 112.453 -179.611 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.434 ' O ' ' HG3' ' A' ' 11' ' ' MET . 79.6 mt -86.19 93.23 8.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.773 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.729 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 3.0 t -87.97 -34.59 18.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.624 -179.383 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.49 -34.92 69.57 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 177.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.3 t -72.22 -36.76 69.23 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.947 177.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.729 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 3.4 mtm -64.59 -37.56 87.99 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.422 178.248 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.574 HD23 ' HB3' ' A' ' 24' ' ' LEU . 65.1 mt -52.76 -50.38 63.62 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.946 179.37 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.39 -26.02 67.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.816 177.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.4 m -101.67 15.19 29.7 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.667 -178.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.71 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -134.38 60.59 44.42 Favored Pre-proline 0 CA--C 1.533 0.323 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.745 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.452 ' N ' ' HD2' ' A' ' 17' ' ' PRO . 50.7 Cg_exo -55.02 -50.25 13.82 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 122.829 2.352 . . . . 0.0 114.124 -177.686 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.452 ' HD2' ' N ' ' A' ' 16' ' ' PRO . 42.4 Cg_endo -66.86 -163.19 0.07 OUTLIER 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 122.044 1.829 . . . . 0.0 112.591 -178.522 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -74.5 55.46 0.64 Allowed 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.745 179.07 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.762 ' HG3' ' HB3' ' A' ' 22' ' ' GLN . 15.7 tp10 -93.02 10.98 29.12 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.594 -179.489 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.607 ' HG2' ' N ' ' A' ' 21' ' ' LYS . 0.1 OUTLIER -50.87 -51.12 54.66 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.326 -179.151 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.641 ' HD2' ' HA ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER -56.37 -26.55 53.29 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.514 -178.327 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.762 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 2.5 tp-100 -73.42 -76.65 0.12 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.92 0.391 . . . . 0.0 111.702 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.72 ' HA ' ' HE3' ' A' ' 11' ' ' MET . 0.0 OUTLIER -68.99 -97.73 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -176.492 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.594 ' HB2' ' CD ' ' A' ' 30' ' ' PRO . 0.4 OUTLIER -59.05 -1.37 0.17 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -176.014 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.54 ' O ' HD21 ' A' ' 24' ' ' LEU . . . 65.06 -118.17 11.69 Favored Glycine 0 N--CA 1.442 -0.901 0 N-CA-C 108.524 -1.83 . . . . 0.0 108.524 -174.764 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.7 ' HG2' HG21 ' A' ' 50' ' ' ILE . 0.4 OUTLIER -76.34 -67.07 0.73 Allowed 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 169.737 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.789 ' HG3' HD23 ' A' ' 31' ' ' LEU . 9.5 tpt180 -160.03 10.11 0.11 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 114.507 -1.224 . . . . 0.0 108.403 177.031 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.693 ' HA ' HD13 ' A' ' 31' ' ' LEU . 4.2 mm? -57.89 -82.41 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.72 -1.127 . . . . 0.0 113.795 -173.005 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.635 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -33.68 -50.0 0.79 Allowed Pre-proline 0 CA--C 1.537 0.471 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -175.071 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.594 ' CD ' ' HB2' ' A' ' 24' ' ' LEU . 12.2 Cg_endo -58.77 -40.6 71.19 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.415 2.076 . . . . 0.0 113.722 -177.612 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.789 HD23 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.52 -47.73 59.01 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 120.077 -0.649 . . . . 0.0 109.79 -179.666 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.772 HG12 HG13 ' A' ' 69' ' ' VAL . 0.3 OUTLIER -73.31 -14.1 16.51 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.156 178.647 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.624 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 55.0 tp60 -62.15 -38.64 89.78 Favored 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 177.016 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.9 -31.1 70.64 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.063 174.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.632 ' HE2' ' HA ' ' A' ' 66' ' ' ARG . 7.0 mtt -101.24 27.54 6.1 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.317 178.062 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.624 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 2.4 p-80 -64.37 -31.91 6.54 Favored Pre-proline 0 CA--C 1.537 0.458 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 -177.306 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.582 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 49.2 Cg_exo -34.71 -34.96 0.1 OUTLIER 'Trans proline' 0 C--N 1.362 1.257 0 C-N-CA 122.29 1.994 . . . . 0.0 112.411 179.399 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 31.9 m -78.3 -86.52 0.06 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.189 -0.459 . . . . 0.0 109.869 176.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.702 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -171.36 62.32 0.03 OUTLIER 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.364 178.406 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.567 ' HB1' ' O ' ' A' ' 32' ' ' ILE . . . -48.44 -33.29 9.04 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.784 0.326 . . . . 0.0 111.578 179.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.635 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -45.26 -59.41 4.62 Favored Glycine 0 CA--C 1.518 0.24 0 CA-C-N 115.841 -0.618 . . . . 0.0 114.169 -178.262 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.724 ' HZ3' ' HA ' ' B' ' 12' ' ' GLU . 0.1 OUTLIER -78.26 -36.13 47.21 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.332 0.494 . . . . 0.0 112.332 -177.622 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.78 HD12 ' HA ' ' A' ' 73' ' ' VAL . 20.9 mt -53.06 -53.71 20.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.4 -177.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.536 HG23 ' CD2' ' A' ' 29' ' ' PHE . 5.1 t -47.9 -43.04 28.48 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-O 121.153 0.502 . . . . 0.0 109.786 177.736 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.875 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -51.78 -66.38 2.6 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.167 -0.924 . . . . 0.0 113.656 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.667 ' HE2' HG21 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -55.33 -47.45 75.64 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -177.225 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.555 HD13 ' HB2' ' B' ' 6' ' ' LEU . 3.3 mm? -79.98 3.46 20.0 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 121.145 -0.222 . . . . 0.0 111.564 -178.852 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.557 ' O ' HD12 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -66.13 -11.6 50.17 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.842 0.354 . . . . 0.0 110.913 179.991 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -77.85 16.36 0.72 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.967 0.413 . . . . 0.0 110.554 178.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.7 HG21 ' HG2' ' A' ' 26' ' ' GLU . 0.3 OUTLIER -83.77 158.77 3.64 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.048 -179.496 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -71.25 161.7 30.66 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.817 -179.111 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.529 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 1.8 m120 -83.92 -28.6 27.75 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.125 177.777 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.3 t -73.85 -36.67 64.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.081 -0.508 . . . . 0.0 109.961 178.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.409 ' HG2' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -75.71 -23.77 56.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.656 179.548 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.54 ' CD1' ' HB2' ' A' ' 27' ' ' ARG . 0.6 OUTLIER -62.61 -47.15 85.02 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 120.916 0.389 . . . . 0.0 109.967 178.939 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 38.5 tp -58.12 -43.68 87.33 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.526 179.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.484 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 0.4 OUTLIER -57.76 -42.09 83.31 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.804 179.257 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.613 ' SD ' ' HE2' ' A' ' 68' ' ' LYS . 19.9 mmt -60.23 -44.08 95.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.072 0.463 . . . . 0.0 110.329 178.528 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.423 ' HB2' ' HG2' ' A' ' 27' ' ' ARG . 8.4 tp -68.46 -16.29 63.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.777 179.513 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.484 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 0.1 OUTLIER -106.81 0.32 23.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.95 179.51 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.626 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 5.5 m -125.66 82.7 63.29 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.121 -179.591 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -58.32 -35.28 98.87 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.217 1.945 . . . . 0.0 111.935 179.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.443 ' O ' ' HB2' ' A' ' 67' ' ' SER . 31.6 mt-10 -78.3 -47.79 17.06 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.887 -179.21 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.626 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 36.9 m -71.7 -53.12 14.52 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.815 0.34 . . . . 0.0 111.709 -177.779 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.657 HD12 ' HB3' ' A' ' 31' ' ' LEU . 0.1 OUTLIER -57.94 -62.11 2.05 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.302 -178.476 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.632 ' HA ' ' HE2' ' A' ' 35' ' ' MET . 0.6 OUTLIER -50.14 -34.05 20.94 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.861 -178.086 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.459 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.5 OUTLIER -69.6 -38.05 77.15 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.105 0.478 . . . . 0.0 110.228 177.806 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.613 ' HE2' ' SD ' ' A' ' 58' ' ' MET . 0.2 OUTLIER -65.96 -58.2 6.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.316 178.938 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.772 HG13 HG12 ' A' ' 32' ' ' ILE . 28.0 t -62.99 -18.99 22.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.509 179.037 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.653 ' O ' HG21 ' A' ' 73' ' ' VAL . 25.1 t0 -56.14 -49.1 74.88 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 176.374 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.45 ' O ' ' HB2' ' A' ' 74' ' ' ALA . 0.5 OUTLIER -69.08 -24.71 64.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.765 176.481 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.754 ' HB1' ' HA ' ' A' ' 69' ' ' VAL . . . -63.91 -43.85 94.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.811 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.78 ' HA ' HD12 ' A' ' 43' ' ' ILE . 2.5 m -61.35 -29.93 46.95 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 177.15 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.45 ' HB2' ' O ' ' A' ' 71' ' ' GLU . . . -68.41 -38.33 81.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.103 178.82 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.667 HG21 ' HE2' ' A' ' 46' ' ' MET . 1.0 OUTLIER -58.15 -35.44 52.9 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-O 120.995 0.426 . . . . 0.0 110.042 179.221 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.702 ' HG ' ' HB3' ' A' ' 39' ' ' LEU . 2.6 tm? -69.26 -47.06 65.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.065 178.487 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.407 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 0.3 OUTLIER -54.25 -37.26 64.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.652 179.54 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.24 -23.95 37.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.784 178.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 16.0 t-160 -59.23 -69.75 0.19 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.992 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.462 ' O ' ' HB2' ' A' ' 84' ' ' ALA . 68.5 mt-30 -64.56 -6.51 7.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.228 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.407 ' HB2' ' O ' ' A' ' 77' ' ' GLN . . . -79.74 -65.14 1.04 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.443 -179.56 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 45.4 mttm -77.32 -22.6 51.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.585 -178.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -74.57 -48.22 28.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.695 0.284 . . . . 0.0 110.86 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.462 ' HB2' ' O ' ' A' ' 80' ' ' GLN . . . -71.63 -25.72 62.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.018 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.08 -28.58 68.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.017 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -85.49 -16.36 39.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.878 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -85.24 69.84 10.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.946 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -79.03 91.03 4.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.146 -179.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -103.9 -37.55 4.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.996 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -96.43 -26.72 15.22 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.86 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -86.19 117.59 25.11 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.915 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -92.32 84.96 5.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.005 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.79 -67.81 0.95 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.931 -179.842 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -97.57 49.38 1.46 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.42 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 11.5 p -86.72 133.01 40.63 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-O 120.549 0.214 . . . . 0.0 111.007 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -78.45 59.02 6.97 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.618 2.212 . . . . 0.0 112.504 -179.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 43.7 m -107.8 -49.69 3.18 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.906 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.025 -0.988 . . . . 0.0 111.042 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 13.0 p . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.817 0.341 . . . . 0.0 111.046 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 8.2 t -95.61 119.49 43.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.99 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 6.4 mtpm? -77.78 130.67 37.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.944 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 8.9 t -79.74 174.72 11.3 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.964 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 24.1 m-20 -104.21 -52.75 2.86 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.876 179.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.566 HD11 ' O ' ' A' ' 68' ' ' LYS . 11.9 mt -66.07 -89.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.765 179.72 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . 0.511 ' HB2' HD12 ' A' ' 47' ' ' LEU . 0.6 OUTLIER -77.47 119.75 78.7 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.955 179.299 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 9.8 Cg_exo -72.34 0.26 7.66 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.344 2.029 . . . . 0.0 111.953 179.416 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 9' ' ' ASN . . . . . 0.449 ' H ' HD21 ' B' ' 7' ' ' ASN . 17.4 m-80 -123.01 45.55 2.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.605 179.494 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.49 98.45 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.505 -179.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.408 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.4 OUTLIER -117.25 138.16 51.91 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.666 179.185 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . 0.724 ' HA ' ' HZ3' ' A' ' 42' ' ' LYS . 0.4 OUTLIER -50.89 160.82 0.42 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.159 -0.473 . . . . 0.0 112.127 -178.758 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 13' ' ' PHE . . . . . 0.875 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.7 OUTLIER -88.14 89.61 8.06 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.472 177.951 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . 0.602 ' HB ' ' HD3' ' B' ' 15' ' ' PRO . 21.8 t -124.69 -53.06 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.271 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -176.683 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 15' ' ' PRO . . . . . 0.602 ' HD3' ' HB ' ' B' ' 14' ' ' VAL . 98.9 Cg_exo -44.45 -34.3 7.41 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 122.315 2.01 . . . . 0.0 112.811 -178.274 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . 0.477 ' O ' ' HD2' ' A' ' 21' ' ' LYS . . . 75.63 -18.23 3.07 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.341 -179.789 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.641 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 12.5 m -94.85 -174.04 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.548 0.214 . . . . 0.0 110.663 179.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 12.4 mttm -59.93 95.46 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.894 0.378 . . . . 0.0 110.93 -179.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.459 ' CE1' ' HG2' ' B' ' 15' ' ' PRO . 0.1 OUTLIER -81.76 106.86 14.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.842 -179.737 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 90.57 70.74 1.22 Allowed Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.875 -0.678 . . . . 0.0 112.34 -179.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -93.36 -19.34 21.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.842 0.353 . . . . 0.0 110.938 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 11.4 mt . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.082 179.955 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.21 0 CA-C-O 120.144 -0.253 . . . . 0.0 112.496 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_exo -72.67 126.65 11.89 Favored 'Cis proline' 0 C--N 1.348 0.55 0 C-N-CA 123.618 -1.409 . . . . 0.0 112.284 0.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.82 119.04 22.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.859 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -100.45 -17.84 23.0 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.774 -0.726 . . . . 0.0 112.391 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.4 m -92.73 111.01 49.13 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 120.564 0.221 . . . . 0.0 110.926 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -68.48 107.89 1.71 Allowed 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.476 2.117 . . . . 0.0 112.248 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.436 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.3 OUTLIER -93.9 116.83 29.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.074 -179.847 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.748 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 5.2 t -87.78 -34.72 18.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.35 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.4 -37.68 78.62 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 176.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.3 t -66.96 -35.36 79.8 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.805 177.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.748 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.5 mtm -64.46 -38.52 91.3 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.19 178.155 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.768 HD22 ' HB3' ' A' ' 24' ' ' LEU . 49.0 mt -52.29 -44.56 65.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.342 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.27 -34.3 77.68 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.96 178.288 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.4 m -101.75 18.49 20.31 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.676 -179.041 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.631 ' HB3' ' HE1' ' A' ' 23' ' ' MET . . . -140.17 114.76 7.66 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.089 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.444 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 40.0 Cg_exo -56.82 169.45 1.83 Allowed 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.542 2.161 . . . . 0.0 112.09 179.738 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -57.33 -30.16 86.73 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.404 2.07 . . . . 0.0 112.134 179.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -72.1 -12.53 61.25 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.953 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.51 ' HA ' ' OE1' ' A' ' 19' ' ' GLU . 0.4 OUTLIER -88.5 6.8 36.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.879 179.996 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.678 ' HG2' ' N ' ' A' ' 21' ' ' LYS . 1.6 pm0 -48.64 -51.9 25.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.905 -176.8 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.678 ' N ' ' HG2' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -59.97 -23.29 63.48 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.567 -0.453 . . . . 0.0 111.692 -177.586 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.674 ' N ' ' HD2' ' A' ' 21' ' ' LYS . 5.2 tt0 -73.5 -78.97 0.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.041 0.448 . . . . 0.0 111.682 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.631 ' HE1' ' HB3' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -69.66 -96.22 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -175.898 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.768 ' HB3' HD22 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -60.77 -2.17 0.51 Allowed 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -174.931 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.556 ' N ' HD21 ' A' ' 24' ' ' LEU . . . 64.65 -116.52 9.11 Favored Glycine 0 N--CA 1.447 -0.576 0 N-CA-C 108.449 -1.861 . . . . 0.0 108.449 -174.488 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.837 ' HG2' HG21 ' A' ' 50' ' ' ILE . 0.3 OUTLIER -76.28 -68.56 0.57 Allowed 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 168.646 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.718 ' HE ' HD12 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -159.92 9.03 0.1 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.176 -1.374 . . . . 0.0 108.022 174.445 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.832 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.03 -74.39 0.07 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.139 -1.391 . . . . 0.0 113.896 -172.982 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.645 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -35.38 -49.14 1.26 Allowed Pre-proline 0 CA--C 1.538 0.504 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -175.646 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.558 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 52.0 Cg_exo -58.83 -43.35 44.55 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 122.316 2.011 . . . . 0.0 113.648 -178.722 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.786 HD11 HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.54 -47.2 61.52 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 120.269 -0.572 . . . . 0.0 110.002 -178.509 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.771 HD11 ' HB ' ' A' ' 43' ' ' ILE . 0.6 OUTLIER -73.43 -12.93 15.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.909 178.073 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.606 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.7 OUTLIER -62.19 -38.54 89.51 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 177.147 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.56 -31.4 70.58 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.039 174.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.552 ' SD ' HG13 ' A' ' 69' ' ' VAL . 6.6 mtt -100.84 27.99 5.55 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.228 178.061 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.606 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 3.7 p-80 -64.9 -31.69 5.77 Favored Pre-proline 0 CA--C 1.536 0.407 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 -177.232 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.544 ' HD3' ' ND1' ' A' ' 36' ' ' HIS . 63.0 Cg_exo -37.75 -29.97 0.13 Allowed 'Trans proline' 0 C--N 1.362 1.286 0 C-N-CA 122.137 1.891 . . . . 0.0 112.278 179.236 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.581 HG22 HG12 ' A' ' 73' ' ' VAL . 6.4 m -78.14 -86.11 0.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.04 177.137 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.476 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.3 OUTLIER -171.39 50.52 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.488 -0.323 . . . . 0.0 111.246 178.642 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.512 ' HB1' ' O ' ' A' ' 32' ' ' ILE . . . -37.78 -36.84 0.2 Allowed 'General case' 0 N--CA 1.467 0.413 0 O-C-N 123.312 0.382 . . . . 0.0 111.92 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.645 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.34 -60.1 5.97 Favored Glycine 0 C--N 1.329 0.173 0 CA-C-N 116.042 -0.526 . . . . 0.0 113.821 -179.409 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.476 ' HG3' ' SD ' ' A' ' 46' ' ' MET . 0.4 OUTLIER -77.32 -30.47 54.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.983 0.392 . . . . 0.0 111.989 -177.681 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.771 ' HB ' HD11 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -54.0 -54.95 16.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 C-N-CA 121.077 -0.249 . . . . 0.0 111.155 -179.281 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.832 ' HA ' HD22 ' A' ' 28' ' ' LEU . 10.7 t -51.56 -47.57 63.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.628 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.557 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -49.8 -59.76 7.08 Favored Glycine 0 CA--C 1.518 0.264 0 C-N-CA 121.161 -0.543 . . . . 0.0 113.309 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.518 ' HB3' ' HB3' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -56.32 -53.79 53.08 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.788 0.294 . . . . 0.0 111.475 -178.731 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.436 HD22 ' N ' ' A' ' 47' ' ' LEU . 2.9 mm? -80.02 10.19 4.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.819 -178.414 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.557 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.99 -17.62 64.8 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.872 0.368 . . . . 0.0 110.731 179.602 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.479 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.0 mm-40 -74.79 17.74 0.2 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.862 179.465 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.837 HG21 ' HG2' ' A' ' 26' ' ' GLU . 0.1 OUTLIER -83.98 160.08 3.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.88 -179.977 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.475 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 1.5 m-20 -70.71 156.82 39.01 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -178.334 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.625 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 2.2 m120 -84.21 -29.62 26.41 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.237 178.153 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.9 m -74.22 -35.18 63.88 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.422 0.629 . . . . 0.0 109.594 177.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.475 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -76.58 -21.6 55.39 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.688 179.657 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.652 HD23 ' HG3' ' A' ' 26' ' ' GLU . 0.9 OUTLIER -65.66 -47.54 75.16 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-O 121.001 0.429 . . . . 0.0 110.04 178.782 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 tt -56.18 -44.31 79.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.685 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -56.61 -39.65 73.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.568 -179.503 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.524 ' HE2' ' HA ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -57.36 -52.82 63.81 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -178.815 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.718 HD12 ' HE ' ' A' ' 27' ' ' ARG . 0.5 OUTLIER -61.53 -19.69 62.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.736 0.303 . . . . 0.0 111.171 -179.364 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -102.57 -6.22 23.05 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.603 178.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.546 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 52.4 m -122.72 81.76 48.65 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.729 -179.757 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.411 ' O ' ' HB2' ' A' ' 66' ' ' ARG . 19.6 Cg_endo -58.01 -30.57 90.45 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.338 2.026 . . . . 0.0 112.189 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -78.4 -50.5 11.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.954 -179.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.419 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 73.1 m -74.6 -29.67 61.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.967 -177.539 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.786 HD22 HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -78.68 -60.03 2.54 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.006 -178.329 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.528 ' N ' HD11 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -53.6 -31.72 48.13 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.636 -0.425 . . . . 0.0 110.539 -178.674 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.469 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 3.0 m -67.82 -36.53 80.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.096 177.687 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.482 ' HE2' ' HE3' ' A' ' 58' ' ' MET . 0.3 OUTLIER -65.31 -60.1 3.35 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.973 178.399 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.681 ' HA ' ' HB3' ' A' ' 72' ' ' ALA . 69.5 t -64.16 -19.71 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.731 -179.629 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.469 ' HB3' ' O ' ' A' ' 67' ' ' SER . 10.9 t70 -55.25 -50.67 68.89 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 176.84 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.429 ' O ' HG12 ' A' ' 75' ' ' VAL . 0.4 OUTLIER -69.22 -30.69 68.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.773 176.777 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.681 ' HB3' ' HA ' ' A' ' 69' ' ' VAL . . . -57.29 -42.41 81.64 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.307 178.299 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.581 HG12 HG22 ' A' ' 38' ' ' THR . 20.9 t -61.8 -31.12 50.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 176.888 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.51 -37.0 65.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.54 179.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.672 HG11 ' HA ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.64 -27.81 35.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-O 120.95 0.405 . . . . 0.0 110.207 179.803 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.708 HD21 HG12 ' A' ' 43' ' ' ILE . 3.0 mm? -71.68 -54.85 9.01 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.639 178.526 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 64.3 mm-40 -51.18 -33.23 26.31 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.372 179.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.407 ' HA ' ' HB2' ' A' ' 81' ' ' ALA . . . -81.28 -32.76 33.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.745 178.24 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.442 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 71.2 t60 -61.21 -48.46 81.41 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.873 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -83.38 0.71 44.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.066 179.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.407 ' HB2' ' HA ' ' A' ' 78' ' ' ALA . . . -79.55 -69.64 0.57 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.394 -179.382 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.485 ' HD3' HG13 ' B' ' 2' ' ' VAL . 0.0 OUTLIER -73.12 -4.14 30.81 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.243 -179.313 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.442 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 13.7 tt0 -91.29 -52.92 4.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.044 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -78.2 -8.38 58.25 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.242 -179.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -74.35 -58.63 3.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.145 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -86.36 -71.28 0.55 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.026 -179.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.08 92.28 4.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.896 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -80.93 -0.15 37.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.187 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -94.96 35.74 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.003 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -78.5 -22.74 46.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.935 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.9 -82.12 0.2 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.098 -179.727 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -81.46 166.23 20.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.085 -179.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -93.68 162.64 13.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.871 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -86.41 56.14 4.73 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.483 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.565 ' N ' ' CD ' ' A' ' 96' ' ' PRO . 9.9 p -84.14 -30.49 0.46 Allowed Pre-proline 0 CA--C 1.54 0.58 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.565 ' CD ' ' N ' ' A' ' 95' ' ' VAL . 96.4 Cg_endo -78.95 126.22 7.03 Favored 'Trans proline' 0 C--N 1.357 1.022 0 C-N-CA 121.783 1.655 . . . . 0.0 112.356 179.663 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 9.2 p -105.84 -76.14 0.61 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.971 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 9.1 m . . . . . 0 C--O 1.25 1.117 0 CA-C-O 118.175 -0.916 . . . . 0.0 111.081 -179.955 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 2.2 t . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.819 0.342 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . 0.485 HG13 ' HD3' ' A' ' 82' ' ' LYS . 36.5 t -81.64 132.86 30.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.949 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 13.3 mtmm -86.46 113.55 22.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.942 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 15.5 t -77.84 -177.58 4.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.862 179.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 25.7 m120 -104.05 -47.96 4.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.847 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.3 mt -73.11 -78.5 0.09 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.678 179.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . 0.498 HD21 ' H ' ' B' ' 9' ' ' ASN . 0.8 OUTLIER -84.0 125.18 73.42 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.022 179.815 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -77.78 0.54 9.73 Favored 'Trans proline' 0 N--CA 1.461 -0.406 0 C-N-CA 122.195 1.93 . . . . 0.0 112.038 178.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 9' ' ' ASN . . . . . 0.612 ' HB3' ' HZ1' ' B' ' 11' ' ' LYS . 55.9 m-80 -123.44 49.63 1.68 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.796 179.66 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . 0.518 ' HB3' ' HB3' ' A' ' 46' ' ' MET . . . -60.66 97.57 0.06 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.576 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.612 ' HZ1' ' HB3' ' B' ' 9' ' ' ASN . 0.3 OUTLIER -117.41 167.71 11.02 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.478 178.559 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -67.25 167.93 11.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.691 0.281 . . . . 0.0 110.86 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 13' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -88.64 117.35 27.54 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.855 -179.61 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 12.0 t -115.43 83.63 10.93 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.551 178.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 15' ' ' PRO . . . . . 0.669 ' HB3' ' HA ' ' A' ' 22' ' ' GLN . 51.7 Cg_exo -55.47 -179.35 0.07 OUTLIER 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.834 2.356 . . . . 0.0 113.057 -178.711 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . 0.544 ' HA2' ' HZ3' ' A' ' 21' ' ' LYS . . . 85.08 -45.22 3.48 Favored Glycine 0 N--CA 1.451 -0.33 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.563 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 1.4 t -116.54 140.81 37.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.723 0.297 . . . . 0.0 111.217 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.634 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 3.4 mttt -60.67 108.91 0.91 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.842 179.813 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -79.89 106.43 11.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.95 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 74.56 81.01 0.48 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.462 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -92.67 -33.5 14.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.054 0.454 . . . . 0.0 110.998 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 3.5 tp . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.199 -0.905 . . . . 0.0 111.115 179.942 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.266 0 N-CA-C 112.429 -0.268 . . . . 0.0 112.429 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -77.42 166.81 25.45 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.548 2.165 . . . . 0.0 112.407 -179.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 8.0 tp -98.1 2.35 48.56 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.881 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.405 ' O ' ' HD3' ' A' ' 6' ' ' PRO . . . -103.61 17.31 50.4 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.623 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 87.4 p -82.27 111.22 26.07 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 120.562 0.22 . . . . 0.0 110.94 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.405 ' HD3' ' O ' ' A' ' 4' ' ' GLY . 25.5 Cg_exo -63.2 138.22 65.53 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.589 2.192 . . . . 0.0 112.297 -179.783 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.413 ' O ' ' HG3' ' A' ' 11' ' ' MET . 3.7 mm? -100.94 -71.3 0.71 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.876 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.793 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 5.0 t -88.01 -27.15 22.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.216 -179.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.39 -40.8 87.75 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 176.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 37.4 t -67.8 -34.6 77.09 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.555 177.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.793 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.7 mtm -64.37 -39.3 93.6 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.264 177.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.78 HD22 ' HB3' ' A' ' 24' ' ' LEU . 45.5 mt -52.3 -45.67 65.63 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.274 -179.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.15 -34.04 77.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.994 178.305 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 37.3 m -101.87 21.65 14.27 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.594 -178.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.554 ' HB3' ' HB3' ' A' ' 19' ' ' GLU . . . -138.0 116.1 9.58 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.159 179.848 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -55.25 168.38 1.4 Allowed 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.679 2.253 . . . . 0.0 112.258 179.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.88 -35.73 94.43 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.448 2.099 . . . . 0.0 112.454 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -70.0 -12.14 61.39 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.052 -179.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.554 ' HB3' ' HB3' ' A' ' 15' ' ' ALA . 0.4 OUTLIER -83.88 9.46 12.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.756 179.709 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.746 HE22 ' HB3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -48.19 -62.88 1.26 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.347 -179.735 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.729 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -55.7 -23.37 28.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.703 -178.103 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.612 ' HB2' ' HZ1' ' A' ' 21' ' ' LYS . 15.8 tt0 -73.08 -79.15 0.08 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.894 0.378 . . . . 0.0 111.766 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.421 ' H ' ' HG3' ' A' ' 23' ' ' MET . 0.0 OUTLIER -69.46 -95.9 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -176.602 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.78 ' HB3' HD22 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -59.77 -1.56 0.28 Allowed 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -175.428 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.52 ' O ' HD21 ' A' ' 24' ' ' LEU . . . 65.08 -116.05 8.45 Favored Glycine 0 N--CA 1.445 -0.733 0 N-CA-C 108.548 -1.821 . . . . 0.0 108.548 -174.374 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.702 ' HG3' HD23 ' A' ' 55' ' ' LEU . 0.5 OUTLIER -75.85 -68.51 0.57 Allowed 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 168.941 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.749 ' HG2' HD12 ' A' ' 59' ' ' LEU . 10.7 tpt180 -159.89 7.69 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 114.136 -1.393 . . . . 0.0 107.794 175.332 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.875 ' HA ' HD11 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -60.71 -71.98 0.12 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.236 -1.347 . . . . 0.0 113.93 -173.414 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.624 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -35.5 -48.12 1.24 Allowed Pre-proline 0 CA--C 1.541 0.603 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -175.926 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.599 ' CD ' ' HB2' ' A' ' 24' ' ' LEU . 20.9 Cg_endo -64.18 -39.11 32.39 Favored 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 122.201 1.934 . . . . 0.0 113.573 -178.027 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.875 HD11 ' HA ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -70.14 -45.92 65.83 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.764 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.767 HD11 ' HB ' ' A' ' 43' ' ' ILE . 0.6 OUTLIER -74.24 -13.72 15.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.932 177.6 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.551 ' HB3' ' O ' ' A' ' 30' ' ' PRO . 1.4 tt0 -62.27 -38.19 88.37 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 177.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.04 -31.0 68.41 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 175.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.534 ' HE2' ' HA ' ' A' ' 66' ' ' ARG . 4.8 mtt -100.34 27.15 5.91 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.026 177.886 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.793 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 8.5 p-80 -66.32 -30.84 3.83 Favored Pre-proline 0 CA--C 1.536 0.439 0 N-CA-C 113.719 1.007 . . . . 0.0 113.719 -176.438 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.793 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 4.1 Cg_exo -39.19 -28.93 0.18 Allowed 'Trans proline' 0 C--N 1.361 1.203 0 C-N-CA 122.271 1.981 . . . . 0.0 112.098 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.658 HG22 HG11 ' A' ' 73' ' ' VAL . 32.9 m -78.43 -83.85 0.08 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.393 177.637 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.46 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.2 OUTLIER -171.09 48.21 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.369 179.277 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.498 ' HB1' ' O ' ' A' ' 32' ' ' ILE . . . -37.41 -37.85 0.21 Allowed 'General case' 0 N--CA 1.469 0.477 0 O-C-N 123.307 0.379 . . . . 0.0 111.975 -179.406 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.624 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.2 -59.76 6.13 Favored Glycine 0 C--N 1.33 0.235 0 CA-C-N 116.139 -0.482 . . . . 0.0 113.815 -179.259 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.752 ' HB3' HD13 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -77.49 -30.99 53.35 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.106 0.409 . . . . 0.0 112.106 -177.587 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.767 ' HB ' HD11 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -54.09 -56.24 10.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.113 -179.249 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.744 ' HA ' HD22 ' A' ' 28' ' ' LEU . 9.1 t -47.89 -49.34 30.04 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.083 -179.381 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.558 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -49.56 -61.94 5.19 Favored Glycine 0 CA--C 1.521 0.423 0 C-N-CA 121.153 -0.546 . . . . 0.0 113.595 -179.375 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.586 ' SD ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.2 -62.87 1.38 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.815 0.307 . . . . 0.0 111.827 -177.79 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.723 HD13 ' HB2' ' B' ' 7' ' ' ASN . 1.6 mm? -70.17 1.74 4.43 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 -177.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.709 ' HA ' HD11 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -66.52 -8.76 28.78 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.942 -0.303 . . . . 0.0 111.161 179.924 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.493 ' HG3' ' O ' ' B' ' 9' ' ' ASN . 2.7 mm-40 -74.65 16.14 0.3 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.414 0.626 . . . . 0.0 109.531 176.755 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.587 HD12 ' HZ3' ' A' ' 68' ' ' LYS . 0.2 OUTLIER -82.41 162.94 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.558 -179.833 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.493 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 3.5 m-20 -70.7 160.8 31.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.9 0.381 . . . . 0.0 111.873 -178.728 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.591 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 4.4 m120 -89.12 -29.35 19.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.689 177.272 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -73.9 -30.72 62.76 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 176.768 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.493 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.1 OUTLIER -78.22 -28.87 48.04 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.675 178.981 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.702 HD23 ' HG3' ' A' ' 26' ' ' GLU . 0.9 OUTLIER -58.69 -44.84 90.41 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 179.428 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.675 ' HA ' HD13 ' A' ' 59' ' ' LEU . 8.0 tt -57.74 -49.18 77.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.37 177.779 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -57.06 -22.64 40.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.685 -179.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.652 ' HB3' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -71.27 -53.67 13.52 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -178.754 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.823 HD11 ' H ' ' A' ' 59' ' ' LEU . 0.0 OUTLIER -68.11 -7.39 29.25 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 119.997 -0.681 . . . . 0.0 110.691 179.891 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 56' ' ' LEU . 4.9 mt-10 -99.46 -11.38 21.15 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.926 176.237 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.538 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 3.4 m -122.32 85.56 47.43 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.184 -179.026 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -62.51 -33.4 78.77 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.186 1.924 . . . . 0.0 111.65 178.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -78.44 -47.02 18.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.485 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.498 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 1.9 m -71.37 -54.9 9.19 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.917 0.389 . . . . 0.0 111.58 -178.304 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.754 HD12 ' HB3' ' A' ' 31' ' ' LEU . 0.2 OUTLIER -58.21 -62.16 2.03 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.707 -177.805 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.534 ' HA ' ' HE2' ' A' ' 35' ' ' MET . 1.5 ttm180 -50.47 -37.16 36.94 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.746 -0.381 . . . . 0.0 111.345 -177.374 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.591 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 1.4 t -69.47 -34.53 74.5 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.312 0.577 . . . . 0.0 110.172 178.144 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.587 ' HZ3' HD12 ' A' ' 50' ' ' ILE . 3.0 ttpp -65.91 -57.23 8.33 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.161 178.716 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.763 HG11 HG12 ' A' ' 32' ' ' ILE . 37.1 t -64.93 -18.89 24.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.25 178.457 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.591 ' HB3' ' O ' ' A' ' 67' ' ' SER . 25.6 t70 -54.29 -48.72 70.96 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 176.727 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -66.08 -35.17 79.79 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.682 176.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.765 ' HA ' HG11 ' A' ' 75' ' ' VAL . . . -55.33 -40.74 71.57 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.35 178.044 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.658 HG11 HG22 ' A' ' 38' ' ' THR . 9.9 t -60.7 -34.21 57.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.026 177.516 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.38 -35.09 65.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.696 -179.543 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.765 HG11 ' HA ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -57.35 -29.68 33.68 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-O 121.019 0.438 . . . . 0.0 109.899 179.53 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.752 HD13 ' HB3' ' A' ' 42' ' ' LYS . 3.7 mm? -71.93 -54.95 8.43 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.772 178.11 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -50.91 -33.81 25.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.252 179.65 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.405 ' HA ' ' HB2' ' A' ' 82' ' ' LYS . . . -81.54 -32.59 32.18 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.662 177.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -61.58 -31.85 71.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.077 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.44 -63.95 1.25 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.78 -179.652 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.63 -57.88 3.46 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -176.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.405 ' HB2' ' HA ' ' A' ' 78' ' ' ALA . 11.1 mmtt -59.03 -20.22 51.08 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 -176.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -94.98 -38.16 10.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.687 0.28 . . . . 0.0 111.132 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -72.8 -20.27 61.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.114 -179.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -74.57 -70.63 0.39 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.975 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -90.49 89.64 7.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.719 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.412 ' H ' ' HG3' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -88.65 -80.12 0.29 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.797 179.836 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -86.68 -3.58 59.06 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.834 179.482 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.8 t -89.21 -13.12 9.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.934 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -79.44 72.97 6.1 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.914 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.5 p -98.56 33.42 2.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.805 179.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -74.73 178.85 5.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.997 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 3.3 p -112.26 154.37 25.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.971 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -85.93 156.7 30.19 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.76 -0.734 . . . . 0.0 112.443 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -108.0 97.73 22.7 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 120.751 0.31 . . . . 0.0 111.205 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.1 -23.68 24.53 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.524 2.149 . . . . 0.0 112.358 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -82.85 129.32 34.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.973 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.2 m . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.964 179.788 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 2.5 m . . . . . 0 N--CA 1.485 1.302 0 CA-C-O 120.839 0.352 . . . . 0.0 111.123 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 3.4 t -99.46 73.29 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.911 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 4.6 mmmt -87.14 22.83 1.96 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.937 -179.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -93.02 164.55 13.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.883 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -120.45 -59.52 1.76 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.977 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.494 HD21 ' O ' ' A' ' 68' ' ' LYS . 7.2 tp -69.58 -72.76 0.18 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.09 -179.769 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . 0.723 ' HB2' HD13 ' A' ' 47' ' ' LEU . 1.8 t30 -88.95 130.24 45.39 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.985 179.668 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 3.4 Cg_exo -76.66 -0.76 10.82 Favored 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 122.476 2.117 . . . . 0.0 112.007 179.347 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 9' ' ' ASN . . . . . 0.493 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 68.9 m-20 -123.23 48.06 1.89 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.005 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.37 99.15 0.07 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.812 -179.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.454 ' O ' ' HA ' ' A' ' 46' ' ' MET . 0.0 OUTLIER -122.37 153.58 38.83 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.679 178.407 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . 0.554 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 5.7 tt0 -55.4 169.85 0.27 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.916 0.388 . . . . 0.0 111.511 -179.464 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 13' ' ' PHE . . . . . 0.452 ' CZ ' HD12 ' A' ' 48' ' ' LEU . 0.9 OUTLIER -88.34 112.99 23.49 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.581 179.554 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -113.41 86.96 10.67 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.541 179.226 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 15' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_endo -55.57 -172.22 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.746 2.298 . . . . 0.0 112.778 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.96 -51.1 4.51 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.271 -179.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -115.57 147.99 18.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.744 0.307 . . . . 0.0 110.967 179.5 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.746 ' HB3' HE22 ' A' ' 20' ' ' GLN . 0.0 OUTLIER -68.56 88.37 0.34 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.716 179.637 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -67.07 115.3 6.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.984 -179.606 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 93.65 35.0 6.32 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.549 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -99.61 15.22 27.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.886 0.374 . . . . 0.0 110.924 179.764 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.959 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.193 0 N-CA-C 112.533 -0.227 . . . . 0.0 112.533 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -61.41 107.21 0.47 Allowed 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.581 2.187 . . . . 0.0 112.247 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.08 98.02 7.08 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.934 -179.886 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -91.54 53.93 3.08 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.52 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -85.29 152.99 58.95 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 120.368 0.128 . . . . 0.0 110.797 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.584 ' HD2' ' HB2' ' A' ' 10' ' ' SER . 12.8 Cg_exo -70.49 -172.09 7.67 Favored 'Cis proline' 0 C--N 1.35 0.638 0 C-N-CA 123.916 -1.285 . . . . 0.0 112.586 -0.038 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.449 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.2 OUTLIER -88.93 -74.28 0.47 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.311 -179.546 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.738 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 8.9 t -87.8 -33.08 18.75 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.89 -178.703 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.537 ' HB1' HE21 ' A' ' 33' ' ' GLN . . . -59.09 -37.11 76.36 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 177.381 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.584 ' HB2' ' HD2' ' A' ' 6' ' ' PRO . 13.4 t -70.45 -34.01 71.96 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.884 177.559 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.738 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 11.8 mtm -64.29 -36.41 84.02 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 177.63 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.593 HD12 ' HB3' ' A' ' 24' ' ' LEU . 2.0 mp -52.12 -52.47 51.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.996 178.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.33 -28.7 68.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.233 178.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.2 p -101.4 17.73 21.92 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.953 -178.097 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.499 ' HB2' ' O ' ' A' ' 11' ' ' MET . . . -138.56 120.78 10.55 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.696 -0.229 . . . . 0.0 111.0 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.469 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 23.1 Cg_endo -60.13 169.69 4.66 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.415 2.077 . . . . 0.0 111.882 179.239 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -56.9 -32.13 91.38 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.362 2.042 . . . . 0.0 112.27 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.5 mt-30 -73.53 -9.84 59.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.107 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.529 ' HA ' ' OE1' ' A' ' 19' ' ' GLU . 0.5 OUTLIER -89.24 7.22 36.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.11 -179.536 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.531 HE21 ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -46.52 -60.5 2.32 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.745 -177.812 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.608 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -56.05 -22.38 27.19 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.913 -177.617 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.608 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 5.9 tt0 -73.37 -78.76 0.09 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.013 0.435 . . . . 0.0 111.428 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.613 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.3 -97.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.68 -176.396 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.613 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -59.62 -2.19 0.33 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -175.714 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.459 ' HA3' HD23 ' A' ' 48' ' ' LEU . . . 65.21 -115.55 7.85 Favored Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 108.672 -1.771 . . . . 0.0 108.672 -174.426 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.612 ' HG3' HD21 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -75.8 -69.65 0.48 Allowed 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 169.386 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.7 ' HG2' HD23 ' A' ' 59' ' ' LEU . 4.8 tpt180 -159.48 13.01 0.14 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.377 -1.283 . . . . 0.0 108.156 175.48 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.461 HD23 ' N ' ' A' ' 28' ' ' LEU . 4.2 mm? -57.41 -83.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.56 -1.2 . . . . 0.0 113.809 -173.187 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.614 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -33.04 -51.47 0.66 Allowed Pre-proline 0 CA--C 1.536 0.404 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 -174.846 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.58 ' HG2' ' O ' ' A' ' 27' ' ' ARG . 10.5 Cg_endo -56.39 -42.0 70.42 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.394 2.062 . . . . 0.0 113.646 -177.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.84 -48.26 54.91 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 120.128 -0.629 . . . . 0.0 109.893 -179.665 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.782 HG12 HG11 ' A' ' 69' ' ' VAL . 0.5 OUTLIER -71.33 -14.1 17.51 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.626 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.037 178.424 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.646 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 1.3 tp-100 -62.19 -39.29 92.23 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.196 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.77 -29.87 69.94 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.257 -0.883 . . . . 0.0 108.964 174.479 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.673 ' SD ' HG13 ' A' ' 69' ' ' VAL . 7.7 mtt -101.99 26.14 7.91 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.349 178.184 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.646 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -64.33 -31.98 6.69 Favored Pre-proline 0 CA--C 1.535 0.392 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -177.897 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.568 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 51.0 Cg_exo -35.0 -34.36 0.1 OUTLIER 'Trans proline' 0 C--N 1.364 1.365 0 C-N-CA 122.16 1.907 . . . . 0.0 112.008 178.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 20.5 m -78.19 -89.63 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 175.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.836 ' HB3' HD12 ' A' ' 76' ' ' LEU . 3.1 tp -171.93 67.63 0.04 OUTLIER 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.427 177.448 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.467 ' CB ' ' HB ' ' A' ' 32' ' ' ILE . . . -50.24 -24.5 2.92 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.804 0.335 . . . . 0.0 111.573 179.542 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.614 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -49.89 -62.98 4.53 Favored Glycine 0 CA--C 1.518 0.265 0 CA-C-N 115.965 -0.562 . . . . 0.0 114.298 -178.177 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.526 ' HG3' ' SD ' ' A' ' 46' ' ' MET . 2.4 tptm -77.42 -32.79 54.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 117.169 0.484 . . . . 0.0 112.03 -177.328 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.675 HD13 ' HA ' ' A' ' 73' ' ' VAL . 18.7 mt -54.21 -55.95 12.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.729 -0.214 . . . . 0.0 111.427 -178.822 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.567 HG23 ' CD2' ' A' ' 29' ' ' PHE . 4.7 t -47.69 -46.86 29.82 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.887 0.375 . . . . 0.0 110.473 179.077 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.702 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -54.44 -61.95 6.7 Favored Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 115.73 -0.668 . . . . 0.0 113.551 -179.559 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.526 ' SD ' ' HG3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.73 -48.07 75.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.859 0.329 . . . . 0.0 111.414 -178.322 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.603 HD13 ' HB2' ' B' ' 7' ' ' ASN . 3.2 mm? -80.1 2.43 24.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.439 -179.493 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.506 ' O ' HD12 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -65.93 -12.41 54.53 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.979 0.418 . . . . 0.0 110.392 179.333 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -78.95 17.85 0.69 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.277 177.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.483 HG21 ' HG2' ' A' ' 26' ' ' GLU . 0.6 OUTLIER -83.58 162.74 3.07 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.876 -179.53 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.429 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 1.8 m-20 -70.76 158.84 35.6 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.769 -178.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.722 ' HA ' HD21 ' A' ' 55' ' ' LEU . 4.7 m120 -83.58 -28.28 28.65 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.788 177.178 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.569 ' HA ' HD21 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -74.51 -32.03 62.37 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.408 0.623 . . . . 0.0 109.902 177.419 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.429 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 1.0 OUTLIER -77.84 -26.61 49.53 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.483 178.92 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.722 HD21 ' HA ' ' A' ' 52' ' ' ASN . 0.5 OUTLIER -62.48 -49.66 74.53 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.654 179.984 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.774 ' HA ' HD21 ' A' ' 59' ' ' LEU . 0.4 OUTLIER -59.59 -40.98 89.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.985 -179.441 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 3.3 m-70 -63.06 -20.61 65.5 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.634 -179.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.693 ' HE3' ' HA ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -76.89 -60.0 2.54 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -178.77 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.774 HD21 ' HA ' ' A' ' 56' ' ' LEU . 2.5 pt? -66.69 -4.06 8.04 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.375 179.662 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.44 ' HB3' ' O ' ' A' ' 56' ' ' LEU . 1.3 tt0 -104.24 -19.12 14.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.894 177.663 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.449 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 0.5 OUTLIER -122.52 87.14 49.08 Favored Pre-proline 0 C--O 1.223 -0.334 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.134 179.398 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -54.3 -34.11 78.74 Favored 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.469 2.113 . . . . 0.0 112.661 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.645 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.0 -48.7 15.59 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.617 -178.998 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.645 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 23.3 m -72.73 -26.68 61.67 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.176 0.512 . . . . 0.0 111.098 -179.193 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.693 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 0.2 OUTLIER -77.8 -65.79 0.92 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.155 -178.6 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.499 ' HA ' ' HE3' ' A' ' 35' ' ' MET . 0.3 OUTLIER -49.75 -28.39 6.11 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.807 -177.854 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.447 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.5 OUTLIER -68.64 -39.56 80.68 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.25 178.348 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.435 ' O ' HD12 ' B' ' 6' ' ' LEU . 0.2 OUTLIER -65.03 -59.91 3.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.211 178.918 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.782 HG11 HG12 ' A' ' 32' ' ' ILE . 54.4 t -63.15 -20.51 26.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.007 -179.426 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.545 ' O ' HG21 ' A' ' 73' ' ' VAL . 23.8 t70 -55.07 -49.72 70.94 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 176.726 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.572 ' HG2' ' HB3' ' B' ' 5' ' ' ASN . 49.1 tt0 -68.97 -26.67 65.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.801 176.834 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.769 ' HB1' ' HA ' ' A' ' 69' ' ' VAL . . . -62.63 -51.84 65.69 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.367 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.675 ' HA ' HD13 ' A' ' 43' ' ' ILE . 5.3 m -56.73 -28.43 27.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.161 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 177.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.527 ' O ' ' HG3' ' A' ' 77' ' ' GLN . . . -72.59 -30.62 64.53 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.342 179.33 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.731 HG13 ' HA ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -67.44 -37.41 78.86 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.189 0 CA-C-O 120.791 0.329 . . . . 0.0 110.532 179.617 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.836 HD12 ' HB3' ' A' ' 39' ' ' LEU . 0.3 OUTLIER -71.87 -52.7 16.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.945 179.548 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.527 ' HG3' ' O ' ' A' ' 74' ' ' ALA . 1.5 pp0? -56.05 -35.18 66.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.121 0.486 . . . . 0.0 109.997 179.556 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.91 -21.09 40.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.613 178.004 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.542 ' O ' ' HB3' ' A' ' 83' ' ' GLU . 11.3 t-160 -68.13 -30.01 69.05 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.718 179.452 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -77.73 6.07 8.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.121 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -80.24 -75.33 0.27 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.863 0.364 . . . . 0.0 111.631 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.454 ' O ' ' HB1' ' A' ' 85' ' ' ALA . 5.2 mtmt -79.9 -23.4 41.84 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.792 -178.197 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.542 ' HB3' ' O ' ' A' ' 79' ' ' HIS . 1.0 OUTLIER -74.48 -34.65 63.15 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.77 0.319 . . . . 0.0 111.086 -179.185 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -75.07 3.62 8.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.418 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.454 ' HB1' ' O ' ' A' ' 82' ' ' LYS . . . -70.63 -6.45 36.95 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.928 0.394 . . . . 0.0 111.008 179.669 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -92.34 -50.71 5.51 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.686 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.542 ' HB3' HG23 ' A' ' 89' ' ' VAL . 0.0 OUTLIER -79.85 156.33 27.41 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.894 179.998 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -89.52 22.47 2.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.065 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.542 HG23 ' HB3' ' A' ' 87' ' ' LYS . 1.4 t -91.81 17.23 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.901 179.879 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -94.58 123.73 38.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.973 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 87.4 p -87.52 162.6 17.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.846 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -88.6 95.57 10.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.059 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 33.9 p -95.7 85.92 4.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.91 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -94.58 -174.7 38.52 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.522 -179.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 26.5 t -87.53 113.86 56.14 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-O 120.557 0.218 . . . . 0.0 111.048 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -55.27 152.61 30.84 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.613 2.208 . . . . 0.0 112.335 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -84.17 -12.16 55.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.024 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 14.6 p . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.052 -0.975 . . . . 0.0 111.11 -179.754 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 6.2 m . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.773 0.32 . . . . 0.0 111.013 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -97.03 97.48 6.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.913 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 4.7 mtmm -85.34 81.53 8.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.903 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.01 -173.32 3.83 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.858 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 5' ' ' ASN . . . . . 0.572 ' HB3' ' HG2' ' A' ' 71' ' ' GLU . 2.0 m-20 -104.03 -78.13 0.56 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.929 -179.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.435 HD12 ' O ' ' A' ' 68' ' ' LYS . 1.9 mt -67.52 -82.85 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.795 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . 0.603 ' HB2' HD13 ' A' ' 47' ' ' LEU . 1.6 t30 -74.66 124.18 89.53 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.917 179.758 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.26 1.98 7.73 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.18 1.92 . . . . 0.0 111.791 178.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 9' ' ' ASN . . . . . 0.673 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 22.8 m120 -123.23 48.54 1.81 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.7 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.33 98.5 0.06 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.708 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.673 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 19.9 mmtp -122.88 153.09 40.1 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.323 178.204 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -55.26 165.0 0.81 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.863 0.363 . . . . 0.0 111.12 -179.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 13' ' ' PHE . . . . . 0.702 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.2 t80 -88.38 68.6 8.91 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.741 -179.538 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . 0.606 ' N ' ' CD ' ' B' ' 15' ' ' PRO . 5.9 m -131.57 26.27 0.12 Allowed Pre-proline 0 CA--C 1.539 0.536 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 15' ' ' PRO . . . . . 0.748 ' HG3' ' HB2' ' B' ' 19' ' ' TYR . 31.6 Cg_endo -57.74 -30.69 89.97 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 122.074 1.849 . . . . 0.0 112.689 179.271 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.41 -48.61 4.08 Favored Glycine 0 N--CA 1.449 -0.459 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 -176.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 22.7 m -115.75 -161.52 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 177.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.489 ' HB2' ' OD1' ' B' ' 21' ' ' ASN . 0.1 OUTLIER -61.47 113.53 2.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.693 0.282 . . . . 0.0 110.862 179.409 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.748 ' HB2' ' HG3' ' B' ' 15' ' ' PRO . 0.3 OUTLIER -85.3 104.93 15.59 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.013 -179.957 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 91.3 75.56 1.31 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.461 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . 0.489 ' OD1' ' HB2' ' B' ' 18' ' ' LYS . 19.2 m120 -94.02 -19.97 20.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.798 0.332 . . . . 0.0 110.984 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 3.2 pt . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.289 -0.862 . . . . 0.0 111.053 -179.862 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.232 0 N-CA-C 112.456 -0.258 . . . . 0.0 112.456 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_exo -57.06 137.9 83.93 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.654 2.236 . . . . 0.0 112.246 179.953 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.41 179.23 7.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.905 179.875 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.94 70.67 2.49 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.625 -179.965 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.554 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.1 OUTLIER -93.05 -50.94 0.27 Allowed Pre-proline 0 CA--C 1.534 0.338 0 N-CA-C 111.486 0.18 . . . . 0.0 111.486 -179.973 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.554 ' HD2' ' N ' ' A' ' 5' ' ' SER . 33.4 Cg_endo -63.92 128.39 21.82 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 122.141 1.894 . . . . 0.0 112.25 179.992 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.438 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.1 OUTLIER -100.89 -63.78 1.1 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.239 -179.574 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.754 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 6.9 t -87.93 -33.3 18.52 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.647 -178.992 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.41 -35.63 74.34 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 177.341 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 5.5 t -71.23 -34.69 71.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.737 177.365 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.754 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.0 mtm -64.23 -36.25 83.48 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.85 177.692 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.712 HD13 ' HB3' ' A' ' 24' ' ' LEU . 1.9 mp -52.41 -53.53 43.91 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.895 178.768 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.42 -26.74 67.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.976 178.268 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.4 22.84 11.92 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.778 -178.654 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.483 ' N ' ' HD3' ' A' ' 16' ' ' PRO . . . -134.23 59.97 40.98 Favored Pre-proline 0 CA--C 1.533 0.312 0 CA-C-O 120.611 0.243 . . . . 0.0 111.065 179.81 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.483 ' HD3' ' N ' ' A' ' 15' ' ' ALA . 51.7 Cg_exo -57.78 -51.24 8.45 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 122.797 2.331 . . . . 0.0 113.946 -178.165 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.403 ' HD2' ' N ' ' A' ' 16' ' ' PRO . 57.9 Cg_endo -70.18 -159.2 0.06 OUTLIER 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 121.901 1.734 . . . . 0.0 112.705 -178.683 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -73.62 68.6 1.21 Allowed 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.748 179.481 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.456 ' O ' ' HB3' ' A' ' 22' ' ' GLN . 0.9 OUTLIER -104.42 15.73 27.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.608 179.883 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.412 ' HA ' HD21 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -53.11 -63.25 1.21 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.637 -179.565 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.45 ' H ' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -56.17 -21.35 22.35 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.2 -179.087 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.456 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 2.1 tp-100 -73.55 -81.04 0.07 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.973 0.416 . . . . 0.0 111.667 179.571 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.733 ' HA ' ' HE2' ' A' ' 11' ' ' MET . 0.0 OUTLIER -69.67 -97.11 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -176.272 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.712 ' HB3' HD13 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -56.93 0.71 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -175.183 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.505 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 65.12 -117.51 10.44 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 108.481 -1.848 . . . . 0.0 108.481 -174.783 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.8 ' HG3' HD22 ' A' ' 55' ' ' LEU . 0.3 OUTLIER -75.54 -68.03 0.61 Allowed 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 168.715 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.821 ' HG3' HD23 ' A' ' 31' ' ' LEU . 1.0 OUTLIER -160.51 7.69 0.09 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.121 -1.4 . . . . 0.0 107.914 174.784 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.818 HD23 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.73 -73.21 0.09 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.387 -1.279 . . . . 0.0 114.139 -173.064 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.635 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -36.46 -49.23 1.81 Allowed Pre-proline 0 CA--C 1.536 0.426 0 N-CA-C 113.612 0.968 . . . . 0.0 113.612 -175.789 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.587 ' HG3' ' HB2' ' A' ' 24' ' ' LEU . 18.9 Cg_endo -61.76 -39.33 53.56 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 122.19 1.926 . . . . 0.0 113.593 -177.41 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.821 HD23 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.15 -46.95 60.49 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 120.26 -0.576 . . . . 0.0 110.087 -179.496 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.716 HG12 HG12 ' A' ' 69' ' ' VAL . 0.7 OUTLIER -72.31 -17.71 18.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.294 -0.412 . . . . 0.0 109.925 177.71 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.641 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 1.0 OUTLIER -63.36 -31.98 73.28 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 176.286 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.25 -27.77 61.76 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 175.011 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.561 ' HE3' HG11 ' A' ' 69' ' ' VAL . 12.2 mtt -99.97 16.82 22.67 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 114.862 -1.063 . . . . 0.0 109.655 177.17 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.805 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 0.4 OUTLIER -63.45 -34.81 13.95 Favored Pre-proline 0 CA--C 1.534 0.345 0 CA-C-N 115.379 -0.828 . . . . 0.0 112.011 -179.235 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.805 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 2.2 Cg_endo -39.87 -30.05 0.35 Allowed 'Trans proline' 0 C--N 1.364 1.369 0 C-N-CA 122.106 1.871 . . . . 0.0 110.713 177.386 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.512 HG23 ' CG1' ' A' ' 73' ' ' VAL . 0.2 OUTLIER -78.18 -84.38 0.08 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.209 175.161 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.724 HD23 HD22 ' A' ' 76' ' ' LEU . 11.7 tp -172.15 63.41 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 177.603 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.34 -176.02 0.06 Allowed 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 175.736 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.635 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . 103.91 -69.21 0.28 Allowed Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.292 -0.956 . . . . 0.0 113.112 179.664 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.677 ' HE3' ' HG2' ' B' ' 12' ' ' GLU . 1.0 OUTLIER -77.25 -34.97 55.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.825 0.345 . . . . 0.0 111.04 -179.655 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.653 ' HB ' HD13 ' A' ' 32' ' ' ILE . 17.6 mt -54.08 -53.03 31.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.108 -179.39 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.818 ' HA ' HD23 ' A' ' 28' ' ' LEU . 8.9 t -54.65 -43.75 72.63 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-O 120.9 0.381 . . . . 0.0 110.313 178.22 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.778 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -48.11 -61.27 5.02 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.573 -0.74 . . . . 0.0 113.457 -178.769 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.688 ' SD ' HG23 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -61.8 -50.08 73.78 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -177.757 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.602 HD12 ' H ' ' B' ' 7' ' ' ASN . 4.0 mm? -78.75 11.05 2.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.602 0.239 . . . . 0.0 111.493 -179.018 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.61 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -63.79 -29.44 70.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.295 -179.186 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.32 29.02 0.15 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.772 0.32 . . . . 0.0 110.921 179.094 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.552 HG21 ' HG2' ' A' ' 26' ' ' GLU . 2.5 tt -82.77 169.78 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.365 179.081 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.553 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 16.8 m-20 -67.54 137.59 55.86 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.537 -179.0 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.712 ' HA ' HD22 ' A' ' 55' ' ' LEU . 4.9 m120 -76.51 -27.71 56.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.171 0.51 . . . . 0.0 109.642 177.198 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 42.6 m -74.05 -31.27 62.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.639 177.437 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.553 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 2.2 mm-40 -77.51 -29.89 52.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.668 178.925 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.8 HD22 ' HG3' ' A' ' 26' ' ' GLU . 0.6 OUTLIER -58.85 -46.73 87.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.284 -179.953 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.438 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 33.1 tp -61.64 -43.6 98.55 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.409 178.843 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 28.8 m80 -66.93 -19.41 65.72 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.982 179.79 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.575 ' HE2' ' HD3' ' A' ' 68' ' ' LYS . 17.9 mmt -72.4 -47.51 48.65 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.988 -179.983 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.633 HD22 ' NE ' ' A' ' 27' ' ' ARG . 0.2 OUTLIER -66.33 -20.91 66.22 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.229 -179.831 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -96.54 -7.54 34.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.716 0.293 . . . . 0.0 111.576 -179.316 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.617 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -122.88 88.39 50.51 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.891 -179.951 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -62.63 -32.1 79.24 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.302 2.001 . . . . 0.0 112.052 179.552 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -78.06 -48.84 15.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.498 -179.776 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 26.1 m -69.49 -48.8 59.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.394 -178.376 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.617 ' HB3' ' O ' ' A' ' 61' ' ' SER . 0.9 OUTLIER -59.75 -64.83 0.81 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.874 -178.662 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.604 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.5 OUTLIER -50.1 -29.38 8.88 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.068 -177.215 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -63.75 -43.96 94.91 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.078 0.466 . . . . 0.0 110.229 178.134 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.575 ' HD3' ' HE2' ' A' ' 58' ' ' MET . 25.6 mtpt -66.16 -60.68 2.57 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.937 179.327 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.764 ' HA ' ' HB1' ' A' ' 72' ' ' ALA . 75.6 t -61.13 -23.18 29.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.194 -178.542 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.429 ' HB2' ' O ' ' A' ' 66' ' ' ARG . 24.8 t70 -55.58 -49.95 71.37 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 176.612 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.639 ' HG2' ' HB3' ' B' ' 5' ' ' ASN . 0.5 OUTLIER -68.9 -28.16 66.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.69 176.542 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.764 ' HB1' ' HA ' ' A' ' 69' ' ' VAL . . . -59.83 -37.66 79.84 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.068 177.933 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.512 ' CG1' HG23 ' A' ' 38' ' ' THR . 28.4 t -66.43 -29.63 47.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 176.975 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.11 -40.39 71.51 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.292 179.46 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.688 HG23 ' SD ' ' A' ' 46' ' ' MET . 0.9 OUTLIER -54.55 -39.33 45.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-O 120.96 0.41 . . . . 0.0 110.222 179.385 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.724 HD22 HD23 ' A' ' 39' ' ' LEU . 1.2 tt -64.28 -46.45 83.64 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.747 -178.751 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 8.7 mm100 -53.86 -35.85 61.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.263 179.428 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.25 -26.91 35.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.469 177.904 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.468 ' O ' ' HB3' ' A' ' 83' ' ' GLU . 4.2 t60 -77.39 -12.04 59.91 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.847 179.724 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.433 ' O ' ' HB2' ' A' ' 84' ' ' ALA . 0.2 OUTLIER -83.38 -35.76 24.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.549 179.427 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.63 -50.29 10.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.508 -179.275 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 3.8 mmtm -61.2 -38.84 88.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.556 -178.666 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.468 ' HB3' ' O ' ' A' ' 79' ' ' HIS . 17.3 tt0 -74.69 -50.94 15.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.322 -178.77 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.433 ' HB2' ' O ' ' A' ' 80' ' ' GLN . . . -63.84 -26.11 68.47 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.531 -179.289 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.65 -74.04 0.11 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.203 -179.523 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -88.36 103.89 16.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.95 -179.705 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 24.2 mttt -93.82 39.38 1.07 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.7 179.919 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -85.92 -0.22 54.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.096 -179.749 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.404 ' H ' HG22 ' A' ' 89' ' ' VAL . 0.0 OUTLIER -99.13 -37.94 6.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.99 179.872 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -90.99 167.62 12.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.918 179.85 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -74.66 105.85 5.94 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.009 -179.91 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.12 -174.63 2.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.029 179.994 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 33.1 p -112.09 170.71 7.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.928 -179.997 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -88.31 -41.63 6.11 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.49 -179.923 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -97.26 135.44 21.86 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.518 0.199 . . . . 0.0 110.954 179.997 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -58.43 -37.01 96.82 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.506 2.137 . . . . 0.0 112.126 179.75 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 9.9 t -103.31 155.11 18.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.571 179.336 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.995 0 CA-C-O 117.984 -1.008 . . . . 0.0 111.112 -179.649 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 14.8 p . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.761 0.315 . . . . 0.0 111.033 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . 0.463 HG13 ' HE1' ' A' ' 79' ' ' HIS . 1.9 t -89.54 119.4 36.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.03 179.904 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 59.4 mmtt -76.9 100.68 5.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.12 -179.685 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 3.3 t -93.48 -165.97 1.43 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.866 179.648 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 5' ' ' ASN . . . . . 0.639 ' HB3' ' HG2' ' A' ' 71' ' ' GLU . 39.2 m-20 -105.49 -59.46 1.76 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.874 179.775 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.454 ' HB3' HD11 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -74.15 -87.87 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.408 179.349 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . 0.727 HD21 ' H ' ' B' ' 9' ' ' ASN . 0.2 OUTLIER -74.41 131.5 80.23 Favored Pre-proline 0 C--N 1.332 -0.176 0 CA-C-N 116.616 -0.265 . . . . 0.0 110.546 178.714 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . 0.519 ' HD2' ' ND2' ' B' ' 7' ' ' ASN . 71.9 Cg_endo -75.24 -3.91 14.59 Favored 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.109 1.872 . . . . 0.0 112.096 179.262 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 9' ' ' ASN . . . . . 0.727 ' H ' HD21 ' B' ' 7' ' ' ASN . 71.8 m-80 -123.35 49.8 1.65 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.657 179.543 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.17 95.0 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.714 -179.283 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.63 ' C ' ' HA ' ' A' ' 46' ' ' MET . 6.0 mttp -109.57 124.26 50.82 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.704 179.288 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . 0.677 ' HG2' ' HE3' ' A' ' 42' ' ' LYS . 51.6 mt-10 -47.48 173.01 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -177.895 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 13' ' ' PHE . . . . . 0.778 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.4 OUTLIER -87.41 77.78 8.81 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.352 -179.929 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . 0.521 ' N ' ' CD ' ' B' ' 15' ' ' PRO . 3.5 m -116.16 -31.78 0.09 OUTLIER Pre-proline 0 CA--C 1.54 0.571 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 -177.359 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 15' ' ' PRO . . . . . 0.521 ' CD ' ' N ' ' B' ' 14' ' ' VAL . 50.3 Cg_exo -54.7 -40.67 83.42 Favored 'Trans proline' 0 C--N 1.357 1.006 0 C-N-CA 121.693 1.595 . . . . 0.0 112.378 -179.197 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 83.73 -31.91 3.25 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.375 -179.694 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 34.9 m -94.91 -172.44 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.713 0.292 . . . . 0.0 110.781 179.643 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.86 91.95 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.907 0.384 . . . . 0.0 110.735 179.937 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.476 ' CG ' ' HG2' ' B' ' 15' ' ' PRO . 1.7 t80 -82.79 103.01 11.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.055 -179.35 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 93.51 76.18 1.32 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.558 -179.948 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 10.3 p-10 -100.26 -14.67 18.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.792 0.33 . . . . 0.0 110.909 179.911 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 6.0 tt . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.279 -0.867 . . . . 0.0 111.024 -179.982 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.116 0 CA-C-O 120.185 -0.23 . . . . 0.0 112.529 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -73.15 -3.76 14.22 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.544 2.163 . . . . 0.0 112.347 -179.913 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -98.28 51.35 1.01 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.861 -179.994 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -84.04 58.79 5.0 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.577 -179.759 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -92.29 -50.76 0.29 Allowed Pre-proline 0 CA--C 1.533 0.325 0 N-CA-C 111.373 0.138 . . . . 0.0 111.373 179.873 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -63.04 -8.25 13.58 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 122.249 1.966 . . . . 0.0 112.393 -179.812 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.442 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.5 OUTLIER -81.78 45.1 0.87 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.06 -179.858 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.718 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 1.8 t -87.95 -33.04 18.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.469 -179.693 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.411 ' HB2' ' OE1' ' A' ' 33' ' ' GLN . . . -59.26 -37.06 76.67 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 177.237 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.4 t -69.08 -35.54 76.61 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.659 177.014 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.718 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.2 mtm -64.17 -36.47 84.16 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.886 177.669 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.734 HD12 ' HB3' ' A' ' 24' ' ' LEU . 2.4 mp -52.27 -48.94 65.0 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.156 179.356 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.02 -31.09 71.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.129 178.903 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 56.8 m -101.44 15.47 28.73 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.757 -178.882 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.619 ' HB2' ' HB3' ' A' ' 19' ' ' GLU . . . -136.44 123.14 14.02 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.031 179.967 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -62.58 168.69 9.51 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.521 2.147 . . . . 0.0 111.826 179.356 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -52.76 -43.36 56.44 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.404 2.07 . . . . 0.0 112.366 179.984 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.13 -16.22 51.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.547 -179.549 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.676 ' HG3' ' HB3' ' A' ' 22' ' ' GLN . 4.6 tp10 -86.22 12.35 10.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.081 -179.478 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.432 ' HG3' ' H ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -52.83 -60.08 3.7 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.345 -179.868 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.512 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.86 -20.54 15.91 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.496 -178.171 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.676 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -73.2 -79.98 0.07 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.908 0.385 . . . . 0.0 111.425 179.317 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.72 ' HE3' ' HA ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.55 -94.39 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.687 -176.979 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.734 ' HB3' HD12 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -62.11 -1.56 0.73 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -175.291 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.574 ' O ' HD23 ' A' ' 24' ' ' LEU . . . 64.87 -116.71 9.27 Favored Glycine 0 N--CA 1.444 -0.794 0 N-CA-C 108.427 -1.869 . . . . 0.0 108.427 -174.268 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.741 ' HG3' HD23 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -76.63 -69.63 0.5 Allowed 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 169.43 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.938 ' HG3' HD22 ' A' ' 31' ' ' LEU . 1.3 tpt180 -159.86 12.46 0.13 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.318 -1.31 . . . . 0.0 107.985 176.09 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.658 ' HA ' HD11 ' A' ' 31' ' ' LEU . 3.6 mm? -57.54 -76.06 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.488 -1.233 . . . . 0.0 113.606 -173.243 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.57 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -41.0 -46.65 6.97 Favored Pre-proline 0 C--N 1.325 -0.495 0 N-CA-C 113.728 1.01 . . . . 0.0 113.728 -174.653 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.582 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 50.4 Cg_exo -57.53 -43.83 47.55 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.236 1.957 . . . . 0.0 113.818 -178.216 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.938 HD22 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.7 -48.83 52.62 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.228 -178.066 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.793 HD11 ' HB ' ' A' ' 43' ' ' ILE . 0.9 OUTLIER -73.43 -14.52 16.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.522 179.15 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.624 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.7 OUTLIER -60.88 -42.33 97.76 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 177.03 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.65 -30.02 70.66 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.143 174.902 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.568 ' SD ' HG13 ' A' ' 69' ' ' VAL . 6.3 mtt -101.41 26.79 6.84 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.657 178.576 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.624 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.4 p-80 -66.04 -32.37 5.61 Favored Pre-proline 0 CA--C 1.537 0.46 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -177.457 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.593 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 44.0 Cg_exo -34.11 -35.9 0.09 OUTLIER 'Trans proline' 0 C--N 1.363 1.318 0 C-N-CA 122.383 2.055 . . . . 0.0 112.466 179.457 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.8 m -78.76 -84.13 0.08 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.816 176.891 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.763 ' HB3' HD22 ' A' ' 76' ' ' LEU . 0.6 OUTLIER -171.36 63.54 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.396 178.212 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.54 ' HB3' ' HB ' ' A' ' 32' ' ' ILE . . . -50.09 -38.29 37.86 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.888 0.375 . . . . 0.0 111.398 179.516 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.57 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -47.94 -47.94 25.24 Favored Glycine 0 CA--C 1.517 0.197 0 CA-C-N 115.782 -0.645 . . . . 0.0 114.13 -178.227 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.848 ' HG3' ' HE1' ' A' ' 46' ' ' MET . 2.2 tptm -77.74 -42.59 33.66 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -177.192 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.793 ' HB ' HD11 ' A' ' 32' ' ' ILE . 20.3 mt -53.51 -56.51 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 C-N-CA 120.761 -0.376 . . . . 0.0 111.288 -178.267 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.56 HG23 ' CD2' ' A' ' 29' ' ' PHE . 9.8 t -47.04 -46.92 22.49 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 179.234 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.902 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -51.57 -67.51 1.96 Allowed Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 115.33 -0.85 . . . . 0.0 113.212 179.352 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.848 ' HE1' ' HG3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.57 -57.75 10.65 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -177.246 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.667 HD22 ' HB2' ' B' ' 7' ' ' ASN . 3.5 mp -79.39 14.52 1.54 Allowed 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -177.068 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.527 HD11 ' O ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -66.71 -10.51 47.48 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.235 0.54 . . . . 0.0 109.543 176.359 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.498 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 3.5 mt-10 -80.17 19.89 0.7 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.711 178.96 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.443 HG12 ' HG2' ' A' ' 54' ' ' GLU . 1.3 tt -83.31 162.64 3.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.021 -179.236 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.446 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 4.0 m-20 -70.66 156.78 39.03 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.946 0.403 . . . . 0.0 111.72 -178.449 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.729 ' HA ' HD23 ' A' ' 55' ' ' LEU . 6.5 m120 -84.09 -30.11 26.26 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.21 178.312 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 8.4 t -73.9 -34.03 64.25 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.369 0.604 . . . . 0.0 109.53 177.342 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.446 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -75.84 -28.54 58.28 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.52 179.147 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.741 HD23 ' HG3' ' A' ' 26' ' ' GLU . 0.7 OUTLIER -59.59 -46.54 88.63 Favored 'General case' 0 CA--C 1.522 -0.128 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.298 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.722 ' HA ' HD22 ' A' ' 59' ' ' LEU . 61.7 tp -57.83 -49.39 76.83 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.072 -179.678 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.446 ' O ' ' HB2' ' A' ' 61' ' ' SER . 19.3 m-70 -58.78 -21.61 56.33 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.806 -178.992 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.647 ' HE2' ' HZ3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -76.17 -57.99 3.54 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -177.742 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.73 HD23 ' H ' ' A' ' 59' ' ' LEU . 2.2 pt? -65.73 -6.86 12.88 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.538 -0.465 . . . . 0.0 111.098 -178.864 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -105.98 -9.43 17.07 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.94 0.4 . . . . 0.0 110.634 177.745 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.581 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -122.66 97.93 43.82 Favored Pre-proline 0 C--N 1.331 -0.199 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.099 179.61 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -64.94 -30.07 57.55 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.188 1.925 . . . . 0.0 111.924 179.114 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.457 ' O ' ' HB2' ' A' ' 67' ' ' SER . 3.2 mm-40 -78.31 -51.77 9.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.615 -179.75 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.412 ' HB3' ' HB3' ' A' ' 61' ' ' SER . 47.3 t -69.23 -40.29 78.01 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.887 -177.819 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.641 HD11 ' HB3' ' A' ' 31' ' ' LEU . 0.3 OUTLIER -77.95 -65.14 1.01 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.177 -176.179 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.49 ' HA ' ' HE3' ' A' ' 35' ' ' MET . 0.0 OUTLIER -51.06 -33.7 26.83 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.885 -0.326 . . . . 0.0 111.524 -176.797 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.457 ' HB2' ' O ' ' A' ' 63' ' ' GLU . 2.9 m -69.97 -35.84 74.75 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.001 0.429 . . . . 0.0 110.195 178.286 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.647 ' HZ3' ' HE2' ' A' ' 58' ' ' MET . 0.5 OUTLIER -66.33 -52.34 48.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.304 178.717 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.81 ' HA ' ' HB2' ' A' ' 72' ' ' ALA . 55.4 t -70.37 -16.37 19.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.484 179.127 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.581 ' O ' HG21 ' A' ' 73' ' ' VAL . 20.1 t0 -58.56 -49.05 78.84 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 176.554 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.532 ' O ' ' HB2' ' A' ' 74' ' ' ALA . 2.4 tp10 -68.7 -21.86 64.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.59 176.258 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.81 ' HB2' ' HA ' ' A' ' 69' ' ' VAL . . . -64.18 -45.38 88.66 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.633 179.353 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.581 HG21 ' O ' ' A' ' 70' ' ' ASP . 2.2 m -59.66 -29.77 43.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 176.852 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.532 ' HB2' ' O ' ' A' ' 71' ' ' GLU . . . -67.76 -25.18 65.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.91 178.398 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.569 HG21 ' N ' ' A' ' 76' ' ' LEU . 1.3 m -69.89 -32.72 52.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 178.723 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.763 HD22 ' HB3' ' A' ' 39' ' ' LEU . 8.0 mt -70.98 -57.67 4.32 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.956 179.09 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.518 ' HG3' ' O ' ' A' ' 74' ' ' ALA . 0.0 OUTLIER -51.27 -35.58 38.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.047 179.976 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.16 -26.49 36.01 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.791 177.775 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.478 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 23.4 t-80 -65.41 -57.48 8.23 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.847 179.94 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -68.94 -13.7 62.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.184 -179.775 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -67.06 -63.37 1.07 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.422 -179.288 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 17.5 mtmt -79.87 -8.21 59.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.424 -178.977 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.478 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 17.8 tp10 -83.53 -43.94 15.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.832 0.348 . . . . 0.0 110.982 -179.945 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -78.74 0.19 27.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.08 -179.909 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -78.08 -52.87 8.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.044 -179.942 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 28.4 mm-40 -83.87 -71.5 0.5 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.895 -179.981 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -79.31 96.76 6.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.886 179.978 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -75.72 82.35 2.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.157 -179.955 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.408 HG12 ' N ' ' A' ' 90' ' ' ASN . 8.7 p -94.44 -21.36 5.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.938 179.921 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.408 ' N ' HG12 ' A' ' 89' ' ' VAL . 1.0 OUTLIER -80.74 142.3 33.96 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.025 179.902 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 32.8 m -76.11 -41.27 50.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.884 -179.93 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -90.68 96.45 10.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.144 -179.96 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 3.0 p -101.98 -63.39 1.16 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.875 179.987 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -94.56 75.07 0.99 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.88 -0.676 . . . . 0.0 112.432 179.867 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 15.2 m -99.07 148.68 34.93 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 120.612 0.244 . . . . 0.0 111.083 -179.898 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -56.93 142.59 93.42 Favored 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.578 2.185 . . . . 0.0 112.32 -179.804 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.1 m -91.84 119.05 31.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.796 179.745 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.3 p . . . . . 0 C--O 1.248 1.019 0 CA-C-O 117.989 -1.005 . . . . 0.0 111.085 -179.799 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . 0.413 ' H3 ' HG22 ' B' ' 1' ' ' VAL . 2.5 t . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.783 0.325 . . . . 0.0 110.951 . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 2.0 t -84.3 157.92 3.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.042 -179.956 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.81 22.47 4.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.856 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -93.19 158.82 15.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.089 -179.808 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -113.76 -58.58 2.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.943 179.967 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.23 -79.16 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.943 179.829 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . 0.667 ' HB2' HD22 ' A' ' 47' ' ' LEU . 2.2 t30 -84.16 127.05 68.21 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.051 -179.841 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -78.65 5.03 5.88 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.236 1.957 . . . . 0.0 111.899 178.593 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -123.54 43.02 3.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.917 179.945 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.78 85.26 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.702 -179.768 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.603 ' C ' ' HA ' ' A' ' 46' ' ' MET . 0.4 OUTLIER -117.61 128.13 54.63 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.051 178.537 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . 0.625 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 6.2 tt0 -46.56 167.47 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -175.846 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 13' ' ' PHE . . . . . 0.902 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.4 OUTLIER -87.41 90.16 8.26 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.206 -0.906 . . . . 0.0 109.91 179.605 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . 0.555 ' HB ' ' HD3' ' B' ' 15' ' ' PRO . 4.0 t -124.66 -52.68 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.331 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -177.388 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 15' ' ' PRO . . . . . 0.555 ' HD3' ' HB ' ' B' ' 14' ' ' VAL . 94.8 Cg_exo -44.98 -36.08 10.87 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 122.382 2.055 . . . . 0.0 112.678 -178.861 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . 0.482 ' O ' ' HB2' ' A' ' 21' ' ' LYS . . . 76.06 -14.82 5.81 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.412 -179.929 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.403 ' H ' ' C ' ' B' ' 15' ' ' PRO . 2.9 m -96.3 -174.83 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.57 0.224 . . . . 0.0 110.618 179.358 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.462 ' HG3' HD21 ' B' ' 21' ' ' ASN . 0.0 OUTLIER -60.1 89.31 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.956 0.408 . . . . 0.0 110.724 179.984 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.461 ' HD2' ' HB3' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -75.66 118.78 18.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.974 -179.351 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 78.76 53.19 4.69 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.458 -179.964 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . 0.462 HD21 ' HG3' ' B' ' 18' ' ' LYS . 2.7 t-20 -98.3 -65.98 0.93 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.09 0.472 . . . . 0.0 111.068 -179.871 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 5.9 pt . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.217 -0.896 . . . . 0.0 111.03 -179.977 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.177 0 N-CA-C 112.497 -0.241 . . . . 0.0 112.497 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -69.83 -23.25 30.67 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.451 2.101 . . . . 0.0 112.274 179.921 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.35 89.45 7.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.863 179.992 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -80.1 78.87 1.77 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.531 -179.948 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.662 ' HB3' ' HD3' ' A' ' 6' ' ' PRO . 33.8 t -82.35 -50.91 0.78 Allowed Pre-proline 0 CA--C 1.533 0.298 0 N-CA-C 111.342 0.127 . . . . 0.0 111.342 -179.998 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.662 ' HD3' ' HB3' ' A' ' 5' ' ' SER . 24.2 Cg_exo -64.22 105.05 0.55 Allowed 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 122.222 1.948 . . . . 0.0 112.346 -179.872 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.415 ' O ' ' HG3' ' A' ' 11' ' ' MET . 2.9 mm? -90.03 -65.1 1.05 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.619 179.413 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.78 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 8.9 t -87.99 -29.17 20.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.07 179.433 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.428 ' HB2' ' HB3' ' A' ' 6' ' ' PRO . . . -59.46 -39.47 83.76 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 176.41 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 7.3 t -67.97 -34.62 76.89 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.734 177.111 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.78 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 9.2 mtm -64.43 -39.18 93.35 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.224 178.07 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.678 HD21 ' HB3' ' A' ' 24' ' ' LEU . 38.5 mt -52.27 -45.91 65.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.406 -179.9 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.15 -33.66 76.28 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.02 178.439 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.9 m -101.52 19.95 16.97 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.559 -179.098 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.449 ' HB2' ' HB3' ' A' ' 19' ' ' GLU . . . -136.52 114.13 10.34 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.096 -179.97 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.406 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 53.8 Cg_exo -52.72 167.73 0.57 Allowed 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.65 2.233 . . . . 0.0 112.345 179.733 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_exo -57.08 -31.04 89.1 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.542 2.161 . . . . 0.0 112.62 -179.527 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -73.98 -8.26 55.46 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.193 -179.581 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.458 ' O ' ' HB3' ' A' ' 22' ' ' GLN . 0.3 OUTLIER -87.53 13.16 10.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.158 -179.553 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.523 HE21 ' HB2' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -46.74 -68.77 0.16 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.351 179.853 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.552 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.54 -20.23 12.5 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.775 -177.195 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.552 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 14.9 tt0 -73.35 -80.05 0.07 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.963 0.411 . . . . 0.0 111.533 179.153 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.431 ' H ' ' HG3' ' A' ' 23' ' ' MET . 0.0 OUTLIER -69.85 -94.14 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 -176.775 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.741 ' HG ' ' HA ' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -61.63 1.6 0.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -174.98 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.479 ' O ' HD21 ' A' ' 24' ' ' LEU . . . 65.1 -117.52 10.47 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 108.598 -1.801 . . . . 0.0 108.598 -174.856 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.5 ' N ' HD22 ' A' ' 48' ' ' LEU . 0.2 OUTLIER -75.42 -67.25 0.68 Allowed 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 168.985 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.857 ' HG2' HD12 ' A' ' 59' ' ' LEU . 8.7 tpt180 -160.3 6.04 0.08 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.188 -1.369 . . . . 0.0 107.862 174.859 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.712 ' HA ' HD12 ' A' ' 31' ' ' LEU . 0.4 OUTLIER -60.01 -75.29 0.06 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.235 -1.348 . . . . 0.0 114.582 -172.175 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.486 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.2 OUTLIER -32.86 -50.81 0.63 Allowed Pre-proline 0 N--CA 1.468 0.468 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -175.484 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.606 ' HG2' ' O ' ' A' ' 27' ' ' ARG . 16.9 Cg_endo -60.25 -40.27 60.72 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 122.132 1.888 . . . . 0.0 113.167 -178.413 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.853 HD23 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.16 -48.42 51.97 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.136 179.844 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.611 HG12 HG12 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -68.47 -20.61 25.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.229 -0.442 . . . . 0.0 109.892 178.045 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.657 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -63.44 -32.31 73.72 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 176.839 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.71 -26.04 63.22 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 174.903 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.44 ' SD ' HG11 ' A' ' 69' ' ' VAL . 10.2 mtt -102.03 14.07 32.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.559 -1.2 . . . . 0.0 109.749 177.471 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.786 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 0.0 OUTLIER -62.51 -36.39 26.91 Favored Pre-proline 0 CA--C 1.533 0.293 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.946 -179.388 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.786 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 1.3 Cg_endo -42.5 -26.98 0.67 Allowed 'Trans proline' 0 C--N 1.362 1.246 0 C-N-CA 121.969 1.779 . . . . 0.0 110.691 177.435 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.48 ' O ' HD22 ' A' ' 39' ' ' LEU . 0.9 OUTLIER -81.93 -82.12 0.14 Allowed 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.37 175.376 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.48 HD22 ' O ' ' A' ' 38' ' ' THR . 0.2 OUTLIER -172.19 65.69 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 178.347 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.444 ' HA ' HD13 ' A' ' 43' ' ' ILE . . . -64.15 -172.52 0.07 Allowed 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 176.098 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.511 ' O ' HG21 ' A' ' 44' ' ' THR . . . 108.38 -106.75 2.38 Favored Glycine 0 C--O 1.227 -0.335 0 C-N-CA 120.172 -1.014 . . . . 0.0 113.056 179.476 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.478 ' HA ' ' HD3' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -56.8 -22.51 36.72 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.659 0.266 . . . . 0.0 111.622 -178.077 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.64 HG12 ' HB2' ' A' ' 76' ' ' LEU . 40.7 mt -54.09 -46.2 66.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.76 0.314 . . . . 0.0 110.934 179.684 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.633 ' HA ' ' CD2' ' A' ' 28' ' ' LEU . 15.4 t -57.14 -44.81 83.74 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.264 -179.606 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -49.36 -43.53 34.79 Favored Glycine 0 CA--C 1.519 0.288 0 C-N-CA 121.2 -0.524 . . . . 0.0 113.766 -178.305 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.659 ' HE3' HG23 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -76.1 -51.9 11.27 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -177.54 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.655 ' HB2' HD22 ' A' ' 28' ' ' LEU . 2.8 mm? -79.67 -0.05 32.35 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.985 -178.693 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.563 ' C ' ' H ' ' A' ' 50' ' ' ILE . 0.2 OUTLIER -66.19 -15.68 63.35 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 121.381 0.61 . . . . 0.0 109.938 177.66 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.493 ' N ' ' OE1' ' A' ' 49' ' ' GLU . 0.6 OUTLIER -74.6 17.08 0.22 Allowed 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.572 179.233 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.563 ' H ' ' C ' ' A' ' 48' ' ' LEU . 1.2 tt -84.59 170.35 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.75 179.368 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.613 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 6.9 m-20 -71.56 147.18 47.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.913 0.387 . . . . 0.0 111.721 179.993 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.522 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 2.1 t-20 -78.56 -30.84 47.04 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 176.771 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.568 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 0.6 OUTLIER -74.14 -30.46 62.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.395 0.617 . . . . 0.0 109.825 177.234 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.613 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -79.22 -22.67 44.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.364 179.068 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.773 HD12 ' HB2' ' A' ' 27' ' ' ARG . 0.6 OUTLIER -63.53 -47.82 80.07 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.392 179.258 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 53' ' ' SER . 2.3 pp -61.29 -41.45 96.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.907 0.384 . . . . 0.0 110.266 179.455 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.0 -13.09 56.96 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.947 178.78 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.615 ' HE2' ' NZ ' ' A' ' 68' ' ' LYS . 22.4 mmt -76.45 -57.38 3.9 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.473 -179.494 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.857 HD12 ' HG2' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -64.3 -10.79 26.33 Favored 'General case' 0 N--CA 1.463 0.176 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.206 179.286 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.488 ' N ' HD22 ' A' ' 59' ' ' LEU . 2.6 tp10 -92.44 -19.12 22.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.276 178.186 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.624 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 1.3 t -122.78 88.48 50.22 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.917 179.369 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -62.5 -31.27 80.42 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.281 1.987 . . . . 0.0 112.202 179.803 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -77.8 -48.44 16.56 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.424 -179.653 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.434 ' O ' ' HB2' ' A' ' 67' ' ' SER . 16.9 m -68.95 -47.73 64.94 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.027 0.442 . . . . 0.0 111.093 -178.935 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.699 HD21 HD22 ' A' ' 31' ' ' LEU . 0.6 OUTLIER -57.93 -64.17 1.0 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.749 -0.66 . . . . 0.0 112.01 -178.575 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.619 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.9 OUTLIER -49.03 -32.24 9.03 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.233 -177.084 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.489 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 5.1 m -58.71 -45.27 89.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.163 0.506 . . . . 0.0 110.196 178.233 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.615 ' NZ ' ' HE2' ' A' ' 58' ' ' MET . 12.3 mtmm -65.48 -64.47 0.85 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.716 179.472 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.803 ' HA ' ' HB2' ' A' ' 72' ' ' ALA . 82.8 t -57.52 -20.16 13.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.358 -178.8 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.489 ' HB3' ' O ' ' A' ' 67' ' ' SER . 5.9 t70 -55.92 -51.3 68.11 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 176.468 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.95 -29.17 67.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.827 177.049 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.803 ' HB2' ' HA ' ' A' ' 69' ' ' VAL . . . -58.61 -40.98 84.81 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.32 178.543 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.609 ' HA ' HD11 ' A' ' 43' ' ' ILE . 24.8 t -62.24 -32.22 54.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 177.061 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.52 -38.63 74.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.289 179.394 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.718 HG13 ' HA ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.9 -27.96 36.86 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 CA-C-O 120.995 0.426 . . . . 0.0 110.337 179.556 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.64 ' HB2' HG12 ' A' ' 43' ' ' ILE . 2.8 tm? -71.07 -48.76 50.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.317 178.865 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -60.1 -33.24 71.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.711 179.914 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.89 -20.08 42.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.871 179.138 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.433 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 12.4 t-80 -63.1 -61.67 2.22 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.879 -179.93 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -71.88 -10.34 59.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.085 -179.991 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -75.68 -56.59 4.54 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.317 -179.617 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.27 -12.89 59.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.352 -179.263 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 0.9 OUTLIER -86.09 -49.57 7.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.057 -179.641 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -76.86 2.36 14.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.163 -179.877 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.63 -24.01 66.94 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.06 179.897 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -78.37 -32.66 49.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.938 179.933 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -93.64 38.73 1.06 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.862 179.938 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -85.54 37.98 0.72 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.115 -179.919 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.2 t -78.76 133.31 30.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.131 -179.88 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -84.07 -51.79 6.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.833 179.91 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -90.58 76.29 6.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.811 179.777 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -79.21 -61.11 2.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.998 179.942 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 14.7 p -96.74 158.71 15.3 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.826 179.981 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -87.05 -40.08 7.18 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.462 179.99 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.8 t -107.28 115.93 58.94 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 120.584 0.23 . . . . 0.0 111.094 -179.928 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -79.06 65.02 8.9 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.626 2.217 . . . . 0.0 112.392 179.874 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.4 t -81.32 -35.28 31.16 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.93 -179.891 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.005 0 CA-C-O 117.925 -1.036 . . . . 0.0 110.979 179.885 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . 0.408 ' H1 ' HG21 ' B' ' 1' ' ' VAL . 1.6 m . . . . . 0 N--CA 1.487 1.415 0 CA-C-O 120.813 0.339 . . . . 0.0 110.963 . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.2 p -93.25 36.62 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.399 0.618 . . . . 0.0 110.824 -179.894 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 10.2 mttt -85.49 52.9 2.58 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.078 179.812 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 4' ' ' SER . . . . . 0.572 ' HG ' HG12 ' A' ' 75' ' ' VAL . 4.9 t -85.79 173.57 9.95 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.909 179.905 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -108.49 -47.71 3.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.923 -179.981 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 35.7 mt -75.98 -79.28 0.1 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.933 -179.97 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . 0.615 HD21 ' H ' ' B' ' 9' ' ' ASN . 0.5 OUTLIER -79.49 127.76 77.33 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.273 -179.36 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -79.76 0.43 10.03 Favored 'Trans proline' 0 N--CA 1.459 -0.508 0 C-N-CA 122.744 2.296 . . . . 0.0 112.072 179.502 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 9' ' ' ASN . . . . . 0.615 ' H ' HD21 ' B' ' 7' ' ' ASN . 44.0 m-20 -123.51 48.82 1.79 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.877 179.845 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . 0.441 ' CA ' ' HB3' ' A' ' 46' ' ' MET . . . -60.89 99.13 0.08 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.081 -0.508 . . . . 0.0 112.068 -179.697 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.539 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.1 OUTLIER -128.0 -178.37 4.49 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 120.776 0.322 . . . . 0.0 110.987 177.432 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -68.61 176.98 2.65 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 121.001 0.429 . . . . 0.0 111.459 -179.55 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 13' ' ' PHE . . . . . 0.479 ' CZ ' HD12 ' A' ' 48' ' ' LEU . 1.0 OUTLIER -93.51 112.37 24.25 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.13 178.053 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 3.0 m -112.97 87.43 10.37 Favored Pre-proline 0 C--N 1.327 -0.396 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.487 179.322 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 15' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -55.82 -167.13 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 123.048 2.499 . . . . 0.0 113.08 -178.52 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . 0.446 ' O ' ' HE3' ' A' ' 21' ' ' LYS . . . 85.07 -56.08 4.98 Favored Glycine 0 N--CA 1.451 -0.336 0 CA-C-N 115.628 -0.714 . . . . 0.0 112.267 -179.297 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 15.7 m -115.94 157.7 16.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.805 0.336 . . . . 0.0 111.321 179.802 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.442 ' HG3' HE22 ' A' ' 20' ' ' GLN . 3.9 mtpp -68.99 92.92 0.54 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.464 178.877 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.432 ' OH ' ' HG3' ' B' ' 11' ' ' LYS . 0.3 OUTLIER -65.06 125.38 24.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.831 0.348 . . . . 0.0 110.738 -179.837 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . 0.47 ' HA3' ' HA ' ' A' ' 49' ' ' GLU . . . 93.9 41.23 4.42 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.285 -179.13 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -88.73 116.17 26.8 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.79 0.329 . . . . 0.0 110.973 -179.902 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 12.6 mt . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.265 -0.874 . . . . 0.0 111.064 -179.873 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.19 0 CA-C-O 120.173 -0.237 . . . . 0.0 112.528 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -74.68 165.38 85.8 Favored 'Cis proline' 0 C--N 1.349 0.584 0 C-N-CA 123.627 -1.405 . . . . 0.0 112.207 0.494 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -83.22 -57.71 3.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.951 179.999 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -105.13 68.32 0.26 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.439 179.942 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.4 t -84.1 122.76 75.89 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 120.624 0.25 . . . . 0.0 110.915 -179.761 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -69.98 79.89 0.98 Allowed 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.457 2.104 . . . . 0.0 112.226 179.638 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.478 ' HB3' ' H ' ' A' ' 8' ' ' THR . 4.8 mt -95.7 -147.96 0.29 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.753 -179.904 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.808 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 13.1 t -87.97 -29.65 20.62 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 179.99 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.45 -35.66 74.48 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 176.869 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 26.8 t -72.96 -34.83 66.74 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.849 177.572 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.808 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 4.8 mtm -64.33 -38.72 92.04 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.013 178.189 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.673 HD23 ' HB3' ' A' ' 24' ' ' LEU . 37.3 mt -52.61 -51.29 60.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.099 179.37 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.25 -28.14 68.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.827 177.953 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.66 20.46 16.15 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.77 -178.702 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.543 ' HB3' ' HE1' ' A' ' 23' ' ' MET . . . -134.44 59.84 39.15 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 120.612 0.244 . . . . 0.0 111.12 -179.924 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.474 ' HD3' ' N ' ' A' ' 15' ' ' ALA . 48.5 Cg_exo -57.3 -49.46 13.82 Favored 'Trans proline' 0 CA--C 1.537 0.647 0 C-N-CA 122.69 2.26 . . . . 0.0 113.964 -178.406 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.458 ' HD2' ' N ' ' A' ' 16' ' ' PRO . 43.2 Cg_endo -67.36 -162.36 0.07 OUTLIER 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 121.963 1.776 . . . . 0.0 112.544 -178.993 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.45 71.12 1.29 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.85 179.744 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.427 ' OE2' ' HG2' ' A' ' 22' ' ' GLN . 0.4 OUTLIER -104.18 5.2 34.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.871 -179.546 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -46.05 -65.73 0.51 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.375 -178.651 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.759 ' HD2' ' HA ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER -55.76 -24.88 37.92 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.265 -178.79 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.427 ' HG2' ' OE2' ' A' ' 19' ' ' GLU . 6.6 tp60 -73.62 -77.36 0.11 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.736 0.303 . . . . 0.0 111.648 179.164 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.676 ' HA ' ' HE2' ' A' ' 11' ' ' MET . 0.0 OUTLIER -67.24 -97.06 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 112.543 0.571 . . . . 0.0 112.543 -176.375 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.673 ' HB3' HD23 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -62.09 1.07 0.33 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 113.604 0.965 . . . . 0.0 113.604 -175.525 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.549 ' HA3' HD22 ' A' ' 48' ' ' LEU . . . 64.71 -118.47 12.55 Favored Glycine 0 N--CA 1.445 -0.757 0 N-CA-C 108.435 -1.866 . . . . 0.0 108.435 -174.865 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 51' ' ' ASP . 1.8 mp0 -75.78 -68.45 0.57 Allowed 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 168.831 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.777 ' HB2' HD12 ' A' ' 55' ' ' LEU . 8.4 tpt85 -160.24 13.26 0.12 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 113.986 -1.461 . . . . 0.0 107.814 174.59 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.668 HD11 ' HA ' ' A' ' 44' ' ' THR . 1.4 mm? -56.98 -80.23 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 114.568 -1.196 . . . . 0.0 113.627 -173.125 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.578 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -36.14 -49.78 1.67 Allowed Pre-proline 0 CA--C 1.537 0.447 0 N-CA-C 113.626 0.972 . . . . 0.0 113.626 -174.501 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.734 ' HB2' ' NH1' ' A' ' 27' ' ' ARG . 50.6 Cg_exo -58.03 -40.92 73.4 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.209 1.939 . . . . 0.0 113.938 -177.852 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.692 HD23 ' NH1' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.86 -47.24 60.37 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 120.343 -0.543 . . . . 0.0 109.906 -179.195 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.766 HG12 HG13 ' A' ' 69' ' ' VAL . 0.3 OUTLIER -74.14 -13.52 15.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.049 178.5 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.627 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 1.5 tt0 -61.46 -42.01 98.1 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 108.55 -0.908 . . . . 0.0 108.55 177.357 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.93 -30.2 70.27 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.077 174.958 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.611 ' HE3' ' HA ' ' A' ' 66' ' ' ARG . 6.7 mtt -100.25 26.11 6.88 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.52 178.364 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.627 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.6 p-80 -63.81 -32.82 8.49 Favored Pre-proline 0 CA--C 1.537 0.445 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -177.726 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.592 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 49.2 Cg_exo -34.56 -35.49 0.1 OUTLIER 'Trans proline' 0 C--N 1.363 1.324 0 C-N-CA 122.316 2.011 . . . . 0.0 112.258 178.897 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.2 m -77.9 -86.11 0.06 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.631 176.547 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.733 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -171.58 65.22 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.302 178.003 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.617 ' HB2' ' HB ' ' A' ' 32' ' ' ILE . . . -49.78 -33.67 17.1 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.452 179.655 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.578 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -50.5 -56.3 13.7 Favored Glycine 0 C--N 1.33 0.201 0 CA-C-N 115.973 -0.558 . . . . 0.0 114.046 -178.294 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.561 ' HE2' ' SD ' ' A' ' 46' ' ' MET . 2.0 tptm -77.54 -38.75 48.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 117.128 0.464 . . . . 0.0 111.952 -177.637 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.711 HD12 ' HA ' ' A' ' 73' ' ' VAL . 18.3 mt -54.33 -56.21 11.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 121.203 -0.199 . . . . 0.0 111.399 -178.698 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.668 ' HA ' HD11 ' A' ' 28' ' ' LEU . 5.8 t -47.69 -47.7 29.57 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 178.552 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.657 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -49.41 -65.48 2.75 Favored Glycine 0 N--CA 1.451 -0.331 0 CA-C-N 115.656 -0.702 . . . . 0.0 113.621 -179.826 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.599 ' HE1' HG21 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -54.48 -71.23 0.08 Allowed 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 -176.599 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.702 HD21 ' HB2' ' B' ' 7' ' ' ASN . 3.7 mp -66.87 6.17 0.54 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -176.621 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.61 ' HB2' ' O ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -66.84 -1.57 4.1 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.051 0.453 . . . . 0.0 110.539 177.125 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.594 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 1.2 mm-40 -81.99 19.08 1.19 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.579 176.716 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.616 HD12 ' HE3' ' A' ' 68' ' ' LYS . 2.0 tt -82.28 165.1 2.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.175 -178.412 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.431 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 34.5 m-20 -70.42 160.95 31.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.731 -178.751 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.508 ' HA ' HD22 ' A' ' 55' ' ' LEU . 5.1 m120 -87.22 -30.29 21.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.872 177.375 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.6 t -73.86 -29.03 61.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.791 177.714 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.425 ' HG3' ' HB2' ' A' ' 51' ' ' ASP . 4.3 mt-10 -79.65 -29.26 40.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.555 178.804 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.777 HD12 ' HB2' ' A' ' 27' ' ' ARG . 0.5 OUTLIER -58.88 -46.49 87.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.976 0.417 . . . . 0.0 110.07 179.395 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.463 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 1.9 tm? -62.62 -41.76 99.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.192 178.623 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.496 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 0.9 OUTLIER -60.88 -34.98 75.45 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.537 178.897 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.547 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -68.91 -43.49 75.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.171 178.758 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.491 ' HB2' ' HG2' ' A' ' 27' ' ' ARG . 5.4 tp -69.79 -15.1 63.06 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.663 179.49 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.496 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 4.6 pt-20 -102.53 -7.92 21.47 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.009 179.456 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.563 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -125.58 89.02 53.26 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.99 179.65 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -61.69 -32.92 86.94 Favored 'Trans proline' 0 C--N 1.343 0.261 0 C-N-CA 122.266 1.977 . . . . 0.0 111.997 179.538 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -78.05 -48.4 16.19 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.489 -179.683 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.419 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 15.5 m -69.37 -52.18 29.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.956 0.408 . . . . 0.0 111.397 -178.641 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.676 HD12 ' HB3' ' A' ' 31' ' ' LEU . 0.1 OUTLIER -58.1 -57.81 11.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.316 -178.53 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.611 ' HA ' ' HE3' ' A' ' 35' ' ' MET . 0.5 OUTLIER -51.8 -33.81 37.3 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.492 -178.936 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.574 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 3.9 m -69.71 -35.96 75.5 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.142 0.496 . . . . 0.0 110.094 177.818 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.616 ' HE3' HD12 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -66.09 -56.78 9.79 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.992 178.233 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.776 ' HA ' ' HB2' ' A' ' 72' ' ' ALA . 49.1 t -67.7 -15.18 19.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.489 178.585 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.641 ' O ' HG22 ' A' ' 73' ' ' VAL . 10.7 t70 -57.62 -49.42 76.49 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 176.362 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.421 ' O ' HG13 ' A' ' 75' ' ' VAL . 22.0 tt0 -68.34 -26.49 65.62 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.44 176.476 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.776 ' HB2' ' HA ' ' A' ' 69' ' ' VAL . . . -62.43 -43.64 98.33 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.183 179.699 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.711 ' HA ' HD12 ' A' ' 43' ' ' ILE . 2.8 m -62.7 -30.58 49.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.941 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.99 -36.57 77.98 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.037 178.872 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.702 HG12 ' HA ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -60.21 -32.31 50.32 Favored 'Isoleucine or valine' 0 C--O 1.231 0.121 0 CA-C-O 121.025 0.441 . . . . 0.0 110.175 179.218 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.733 ' HG ' ' HB3' ' A' ' 39' ' ' LEU . 2.6 tm? -71.75 -47.93 50.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.203 178.51 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -55.79 -36.99 68.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.51 179.343 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.49 -15.62 54.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.205 179.527 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.462 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 0.1 OUTLIER -64.74 -54.44 31.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.804 0.335 . . . . 0.0 111.024 -179.618 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 11.6 mp0 -62.73 -10.32 12.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.859 -178.828 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -60.21 -68.66 0.27 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.712 0.291 . . . . 0.0 110.96 179.713 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.48 -12.34 59.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.894 179.689 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.462 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -84.73 -12.59 53.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.809 179.726 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.61 -23.0 67.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.033 179.908 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -72.42 -11.17 60.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.006 179.992 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -91.36 -48.6 6.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.858 -179.982 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt -92.48 109.83 21.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.958 -179.812 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -85.21 84.95 7.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.89 179.648 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.494 ' H ' HG21 ' A' ' 89' ' ' VAL . 0.0 OUTLIER -95.06 165.73 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.093 -179.822 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -79.84 -20.07 46.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.925 179.923 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 9.1 t -94.83 57.35 2.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.863 179.994 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -91.79 29.01 1.64 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.094 -179.881 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.19 3.04 51.67 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.946 -179.962 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -81.55 -39.63 12.04 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.492 179.854 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 12.3 m -87.72 151.22 49.81 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 120.462 0.172 . . . . 0.0 111.03 179.913 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -72.26 157.71 97.54 Favored 'Cis proline' 0 C--N 1.349 0.588 0 C-N-CA 123.898 -1.292 . . . . 0.0 112.333 0.77 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 72.7 p -79.82 150.79 30.58 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.909 -179.929 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 27.0 m . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.109 -0.948 . . . . 0.0 111.124 -179.988 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . 0.52 HG12 ' HD3' ' B' ' 11' ' ' LYS . 5.8 m . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.878 0.37 . . . . 0.0 111.102 . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -99.82 175.94 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.969 179.806 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -94.34 119.09 32.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.968 -179.873 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 4' ' ' SER . . . . . 0.508 ' HB2' ' HB2' ' B' ' 10' ' ' ALA . 4.7 t -86.16 -168.8 2.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.92 -179.84 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -108.34 -54.29 2.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.044 -179.62 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.458 HD22 ' O ' ' A' ' 68' ' ' LYS . 41.7 tp -76.41 -76.31 0.17 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.812 179.995 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . 0.702 ' HB2' HD21 ' A' ' 47' ' ' LEU . 2.1 t30 -83.4 122.27 77.03 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.74 179.341 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 5.2 Cg_exo -77.61 7.37 3.89 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 122.543 2.162 . . . . 0.0 111.858 179.381 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 9' ' ' ASN . . . . . 0.412 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 4.0 m120 -123.15 38.39 4.2 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.08 -179.593 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . 0.508 ' HB2' ' HB2' ' B' ' 4' ' ' SER . . . -59.57 89.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.852 -179.266 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.594 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 1.1 mmtp -125.71 129.96 50.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.828 177.952 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . 0.529 ' HG2' ' HZ1' ' A' ' 42' ' ' LYS . 6.6 mt-10 -46.63 170.72 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -176.282 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 13' ' ' PHE . . . . . 0.657 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.4 OUTLIER -86.45 94.2 9.34 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.163 178.946 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . 0.596 ' HB ' ' HD3' ' B' ' 15' ' ' PRO . 42.5 t -130.26 -53.26 0.03 OUTLIER Pre-proline 0 C--N 1.327 -0.397 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -175.992 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 15' ' ' PRO . . . . . 0.596 ' HD3' ' HB ' ' B' ' 14' ' ' VAL . 97.3 Cg_exo -44.56 -30.24 3.85 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 122.316 2.011 . . . . 0.0 112.987 -177.784 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . 0.49 ' O ' ' HB2' ' A' ' 21' ' ' LYS . . . 72.59 -13.22 3.07 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.236 -179.56 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.759 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 26.4 m -107.78 -172.09 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.546 0.213 . . . . 0.0 110.452 179.268 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.37 91.52 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.893 0.378 . . . . 0.0 110.839 -179.846 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.433 ' CD1' ' HG2' ' B' ' 15' ' ' PRO . 0.1 OUTLIER -77.89 125.19 28.98 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.996 -179.696 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 88.14 43.05 5.74 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.491 -179.817 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -91.82 109.93 21.27 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.77 0.319 . . . . 0.0 110.961 -179.931 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 7.5 mt . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.238 -0.887 . . . . 0.0 111.087 179.897 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.188 0 CA-C-O 120.097 -0.28 . . . . 0.0 112.481 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -73.2 -47.56 0.31 Allowed 'Cis proline' 0 C--N 1.348 0.508 0 C-N-CA 123.585 -1.423 . . . . 0.0 112.256 0.449 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -90.94 163.36 14.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.859 179.947 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -105.4 61.15 0.37 Allowed Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.502 -179.967 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -89.36 150.41 44.63 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 120.571 0.224 . . . . 0.0 110.9 179.982 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.18 -7.64 17.89 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.564 2.176 . . . . 0.0 112.344 179.958 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.566 HD22 ' HB2' ' A' ' 10' ' ' SER . 1.6 mp -80.86 99.55 8.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.849 179.878 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.752 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 15.1 t -87.71 -35.52 17.9 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.257 -179.681 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.5 -36.25 75.69 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 176.566 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.566 ' HB2' HD22 ' A' ' 7' ' ' LEU . 16.8 t -67.77 -34.83 77.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.668 177.399 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.752 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 9.6 mtm -64.26 -37.34 87.12 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.006 177.696 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.765 HD11 ' HB3' ' A' ' 24' ' ' LEU . 2.0 mp -51.9 -47.67 64.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.096 179.364 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.26 -34.33 77.76 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.23 178.644 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.2 m -100.36 21.95 12.34 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.631 -178.63 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.512 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -136.92 121.84 12.73 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.012 179.568 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -57.9 168.7 3.17 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.534 2.156 . . . . 0.0 111.948 179.518 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -56.76 -36.32 98.44 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.499 2.133 . . . . 0.0 112.306 -179.909 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -73.51 -9.19 58.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.152 -179.799 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.512 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 1.2 tp10 -86.27 10.31 15.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.287 -179.486 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.42 HE21 ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -51.02 -59.84 3.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.299 -179.92 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.435 ' HB2' ' O ' ' B' ' 16' ' ' GLY . 0.0 OUTLIER -55.65 -21.47 18.16 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.514 -178.122 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.467 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 5.4 tt0 -73.2 -79.24 0.08 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.989 0.423 . . . . 0.0 111.512 179.206 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.738 ' HE3' ' HA ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.32 -94.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.795 -0.638 . . . . 0.0 112.685 -176.935 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.765 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -62.02 -0.81 0.55 Allowed 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.434 0.902 . . . . 0.0 113.434 -175.363 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.577 ' O ' HD21 ' A' ' 24' ' ' LEU . . . 64.86 -117.18 9.96 Favored Glycine 0 N--CA 1.444 -0.815 0 N-CA-C 108.474 -1.85 . . . . 0.0 108.474 -174.853 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.654 ' HG3' HD21 ' A' ' 55' ' ' LEU . 0.7 OUTLIER -76.08 -68.73 0.55 Allowed 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 169.247 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.862 ' HB2' HD12 ' A' ' 55' ' ' LEU . 7.8 tpt180 -160.07 12.84 0.12 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 114.47 -1.241 . . . . 0.0 108.424 175.673 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.496 ' O ' HG13 ' A' ' 32' ' ' ILE . 4.0 mm? -57.02 -78.89 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.622 -1.172 . . . . 0.0 113.623 -173.043 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.595 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -36.6 -48.92 1.85 Allowed Pre-proline 0 CA--C 1.537 0.452 0 N-CA-C 113.48 0.919 . . . . 0.0 113.48 -175.062 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.566 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 52.4 Cg_exo -56.62 -43.42 55.26 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.293 1.995 . . . . 0.0 113.719 -178.279 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.61 -46.08 64.06 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.169 0.509 . . . . 0.0 110.124 -178.242 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.714 HD12 ' HB ' ' A' ' 43' ' ' ILE . 0.3 OUTLIER -77.72 -12.38 13.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.453 179.105 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.619 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 11.2 tp60 -62.65 -38.67 91.19 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 176.654 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.73 -31.51 70.64 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.053 -0.976 . . . . 0.0 108.967 174.482 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.641 ' SD ' HG13 ' A' ' 69' ' ' VAL . 7.6 mtt -100.27 27.43 5.68 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.35 178.023 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.807 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 1.7 p-80 -63.63 -32.88 8.78 Favored Pre-proline 0 CA--C 1.536 0.423 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -177.869 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.807 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 3.4 Cg_exo -35.3 -32.82 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.284 0 C-N-CA 122.687 2.258 . . . . 0.0 112.211 179.488 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.402 ' N ' ' O ' ' A' ' 36' ' ' HIS . 45.4 m -78.09 -86.83 0.06 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.101 -0.499 . . . . 0.0 109.811 176.637 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.658 ' O ' HG13 ' A' ' 43' ' ' ILE . 6.1 tp -171.47 56.08 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.512 178.175 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.6 ' HB2' ' HB ' ' A' ' 32' ' ' ILE . . . -39.87 -34.7 0.29 Allowed 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -179.865 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.595 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.58 -58.96 6.96 Favored Glycine 0 CA--C 1.519 0.289 0 CA-C-N 116.058 -0.519 . . . . 0.0 114.021 -179.049 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.74 ' HB3' HD13 ' A' ' 76' ' ' LEU . 0.3 OUTLIER -77.48 -30.35 53.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 117.068 0.434 . . . . 0.0 111.574 -178.356 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.717 HG12 HD23 ' A' ' 76' ' ' LEU . 5.1 mt -57.19 -58.21 6.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.116 -179.271 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.584 HG23 ' CD2' ' A' ' 29' ' ' PHE . 5.3 t -47.72 -45.89 29.23 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.984 0.421 . . . . 0.0 110.526 178.661 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.734 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -50.86 -66.94 2.16 Favored Glycine 0 N--CA 1.452 -0.279 0 CA-C-N 115.511 -0.768 . . . . 0.0 113.709 -179.28 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.642 ' SD ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.37 -49.99 70.86 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 117.047 0.423 . . . . 0.0 111.527 -177.744 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.534 ' N ' HD21 ' A' ' 47' ' ' LEU . 2.9 mm? -76.49 3.33 11.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.542 -178.389 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.53 ' O ' HD12 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -66.29 -10.29 41.08 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.991 0.424 . . . . 0.0 110.55 179.545 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' B' ' 9' ' ' ASN . 3.1 mm-40 -82.39 19.71 1.19 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.508 178.438 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.543 HD11 ' NZ ' ' A' ' 68' ' ' LYS . 1.1 tt -83.57 164.32 2.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.024 -179.409 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -70.97 157.95 37.33 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.498 -179.404 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.475 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 4.4 m120 -86.1 -29.81 23.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.148 178.14 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -73.32 -33.77 65.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.232 0.539 . . . . 0.0 109.579 177.706 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.425 ' O ' ' SD ' ' A' ' 58' ' ' MET . 3.4 mt-10 -75.73 -29.25 58.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.688 178.945 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.862 HD12 ' HB2' ' A' ' 27' ' ' ARG . 0.7 OUTLIER -58.46 -46.8 85.85 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.877 0.37 . . . . 0.0 110.213 -179.922 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.684 ' HA ' HD11 ' A' ' 59' ' ' LEU . 1.6 tt -59.5 -46.01 90.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.759 179.342 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.574 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 1.5 m80 -62.12 -16.91 55.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.548 -179.519 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.784 ' HE3' ' HD3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -75.88 -56.53 4.59 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 -178.462 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.729 ' H ' HD12 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -64.38 -12.0 38.38 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.269 -0.573 . . . . 0.0 110.678 179.953 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.574 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 2.4 pt-20 -98.7 -12.29 21.15 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.899 179.283 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.529 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.3 OUTLIER -122.96 92.04 49.42 Favored Pre-proline 0 C--N 1.332 -0.186 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.079 179.886 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.411 ' O ' ' HB2' ' A' ' 66' ' ' ARG . 36.0 Cg_endo -64.49 -31.29 61.24 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.337 2.025 . . . . 0.0 112.009 179.409 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.623 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.63 -47.14 17.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.267 179.895 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.623 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 15.1 m -70.95 -55.55 8.12 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.503 -178.564 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.733 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 0.2 OUTLIER -58.19 -61.52 2.5 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.613 -178.184 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.524 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -50.26 -31.21 13.55 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.94 -178.043 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.504 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.6 OUTLIER -68.17 -40.76 82.2 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.1 0.476 . . . . 0.0 110.294 177.949 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.784 ' HD3' ' HE3' ' A' ' 58' ' ' MET . 30.0 mtpt -65.86 -59.38 3.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.566 179.299 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.711 HG11 HG12 ' A' ' 32' ' ' ILE . 44.8 t -60.53 -20.99 22.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.486 179.86 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.574 ' O ' HG22 ' A' ' 73' ' ' VAL . 28.3 t0 -55.61 -48.87 74.18 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.219 -0.659 . . . . 0.0 109.219 176.55 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.498 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 1.1 tt0 -68.98 -26.69 65.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.936 176.845 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.634 ' HB1' ' HA ' ' A' ' 69' ' ' VAL . . . -62.35 -53.36 56.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.022 179.871 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.643 ' HA ' HD11 ' A' ' 43' ' ' ILE . 2.8 m -54.23 -29.4 19.34 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 177.356 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.498 ' HB1' ' O ' ' A' ' 71' ' ' GLU . . . -70.78 -36.43 73.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.466 179.856 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.558 HG21 HD21 ' A' ' 76' ' ' LEU . 1.5 m -56.23 -28.37 25.6 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 178.673 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.74 HD13 ' HB3' ' A' ' 42' ' ' LYS . 1.6 mm? -71.83 -51.63 21.5 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.126 176.846 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -52.81 -35.16 56.55 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.854 178.507 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -82.29 -21.46 36.15 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.185 178.173 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.451 ' O ' ' HB3' ' A' ' 83' ' ' GLU . 9.4 t-80 -58.84 -63.12 1.41 Allowed 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.886 -179.373 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 58.0 mt-30 -68.28 -3.06 9.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.329 -179.621 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.74 -68.69 0.64 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.387 -179.49 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 6.6 mmtm -75.35 -18.02 60.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.586 -178.783 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.451 ' HB3' ' O ' ' A' ' 79' ' ' HIS . 9.2 tp10 -79.9 -50.17 10.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.066 -179.566 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -77.43 -1.77 31.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.185 -179.89 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -71.02 -43.39 68.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.962 179.971 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.16 83.38 6.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.867 -179.915 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.81 7.15 46.86 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.951 179.977 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -88.5 -1.81 58.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.171 -179.659 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.404 ' O ' HG13 ' A' ' 89' ' ' VAL . 7.1 p -104.76 130.49 55.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.098 -179.929 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -104.54 125.46 50.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.899 179.884 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.464 ' HB2' ' H ' ' A' ' 92' ' ' ALA . 0.7 OUTLIER -95.11 -88.76 0.25 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.942 -179.989 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.464 ' H ' ' HB2' ' A' ' 91' ' ' SER . . . -92.87 -71.2 0.66 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.112 179.999 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 19.5 p -117.82 -169.98 1.78 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.864 -179.807 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -77.2 -120.4 0.19 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.506 179.984 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.2 m -107.73 122.1 42.02 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 120.625 0.25 . . . . 0.0 111.131 -179.99 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -70.64 78.04 1.34 Allowed 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.763 2.308 . . . . 0.0 112.138 -179.961 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.08 132.39 51.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.849 -179.929 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 1.3 m . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.138 -0.934 . . . . 0.0 111.084 179.813 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 7.2 p . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 120.894 0.378 . . . . 0.0 111.139 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . 0.446 HG12 ' H ' ' B' ' 10' ' ' ALA . 2.2 t -88.83 110.41 21.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.88 179.828 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.91 16.27 18.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.193 -179.354 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 4' ' ' SER . . . . . 0.437 ' HG ' ' HB1' ' B' ' 10' ' ' ALA . 30.3 m -93.65 158.04 15.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.992 179.678 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -103.97 -38.07 7.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.46 179.176 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.4 tp -75.23 -81.59 0.07 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.782 179.272 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . 0.471 HD21 ' H ' ' B' ' 9' ' ' ASN . 0.6 OUTLIER -79.83 120.16 79.08 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.193 179.883 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -76.01 3.09 6.42 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.196 1.93 . . . . 0.0 111.67 178.415 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 9' ' ' ASN . . . . . 0.511 ' HB3' ' NZ ' ' B' ' 11' ' ' LYS . 5.4 m120 -123.3 48.09 1.89 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.477 179.354 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . 0.536 ' HB2' ' HB3' ' A' ' 46' ' ' MET . . . -59.44 96.83 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.801 -179.087 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.511 ' NZ ' ' HB3' ' B' ' 9' ' ' ASN . 8.3 mttp -125.19 133.78 52.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.076 178.189 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . 0.61 ' HG2' ' HE3' ' A' ' 42' ' ' LYS . 44.9 mt-10 -48.29 165.43 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.033 0.444 . . . . 0.0 111.982 -178.591 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 13' ' ' PHE . . . . . 0.734 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.8 OUTLIER -87.32 83.9 7.29 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.435 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . 0.778 ' H ' ' HD2' ' B' ' 15' ' ' PRO . 1.7 m -125.85 -36.02 0.04 OUTLIER Pre-proline 0 CA--C 1.539 0.555 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 -174.648 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 15' ' ' PRO . . . . . 0.778 ' HD2' ' H ' ' B' ' 14' ' ' VAL . 12.1 Cg_endo -54.78 -34.08 83.31 Favored 'Trans proline' 0 C--N 1.355 0.887 0 C-N-CA 121.704 1.603 . . . . 0.0 112.576 -178.07 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . 0.435 ' O ' ' HB2' ' A' ' 21' ' ' LYS . . . 78.45 -23.67 2.81 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.279 -179.505 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.419 ' H ' ' C ' ' B' ' 15' ' ' PRO . 2.1 p -94.77 -178.7 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 N-CA-C 110.309 -0.256 . . . . 0.0 110.309 179.403 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.55 94.65 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.891 0.377 . . . . 0.0 110.998 -179.174 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.409 ' CD1' ' HG3' ' B' ' 15' ' ' PRO . 0.1 OUTLIER -79.72 114.42 18.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.823 -179.771 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 89.45 36.31 7.53 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.282 -179.339 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -83.6 94.13 8.02 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.763 0.316 . . . . 0.0 110.922 -179.774 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.233 -0.889 . . . . 0.0 111.045 179.968 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.263 0 N-CA-C 112.508 -0.237 . . . . 0.0 112.508 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -59.58 -17.05 39.65 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.603 2.202 . . . . 0.0 112.333 -179.775 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 9.4 mt -83.09 -48.59 10.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.987 -179.813 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -84.56 58.15 5.0 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.5 -179.803 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -95.45 147.65 33.35 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 120.607 0.241 . . . . 0.0 110.9 179.953 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -69.82 8.19 0.84 Allowed 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.736 2.291 . . . . 0.0 112.528 -179.679 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.447 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.1 OUTLIER -82.84 39.94 0.66 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.174 -179.732 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.746 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 7.2 t -87.92 -33.09 18.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.484 -179.929 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.433 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.5 -36.89 76.92 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 176.948 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.0 t -68.93 -35.5 76.87 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.599 177.318 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.746 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.3 mtm -64.42 -36.05 82.9 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.972 177.506 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.711 ' HA ' ' HE3' ' A' ' 23' ' ' MET . 3.1 mp -52.15 -48.18 65.03 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.113 179.185 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.02 -33.86 76.78 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.15 178.846 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.7 m -101.5 25.53 8.3 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.715 -178.811 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.47 ' HB3' ' HB3' ' A' ' 19' ' ' GLU . . . -138.04 120.29 10.86 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.271 179.556 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.638 ' HG2' ' HB2' ' A' ' 19' ' ' GLU . 19.3 Cg_endo -59.55 167.82 6.04 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.61 2.207 . . . . 0.0 111.854 179.033 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.19 -40.95 83.08 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.552 2.168 . . . . 0.0 112.537 -179.66 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -73.18 -8.91 57.85 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.014 -179.778 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.638 ' HB2' ' HG2' ' A' ' 16' ' ' PRO . 1.4 tp10 -91.67 15.33 12.9 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.043 -179.637 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.546 HE21 ' HB2' ' A' ' 21' ' ' LYS . 0.2 OUTLIER -59.23 -49.27 78.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.011 0.434 . . . . 0.0 110.764 -179.723 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.546 ' HB2' HE21 ' A' ' 20' ' ' GLN . 0.3 OUTLIER -56.82 -22.46 36.63 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.159 -179.303 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.511 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 4.1 tt0 -72.96 -76.5 0.12 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.946 0.403 . . . . 0.0 111.413 179.728 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.711 ' HE3' ' HA ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.73 -95.76 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -176.854 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.547 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -62.14 1.64 0.29 Allowed 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -175.602 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.55 -116.49 9.09 Favored Glycine 0 N--CA 1.444 -0.816 0 N-CA-C 108.226 -1.95 . . . . 0.0 108.226 -174.376 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.562 ' HB3' ' HB2' ' A' ' 55' ' ' LEU . 1.9 mp0 -75.75 -69.18 0.51 Allowed 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 168.814 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.844 ' HG3' HD21 ' A' ' 31' ' ' LEU . 23.3 tpt180 -160.25 8.9 0.1 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.132 -1.394 . . . . 0.0 107.458 175.416 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.57 HD22 ' HB2' ' A' ' 47' ' ' LEU . 0.2 OUTLIER -58.28 -74.82 0.06 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.398 -1.274 . . . . 0.0 113.879 -172.259 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.618 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -38.54 -47.0 3.18 Favored Pre-proline 0 CA--C 1.536 0.441 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 -175.229 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.488 ' HD2' ' O ' ' A' ' 27' ' ' ARG . 52.2 Cg_exo -57.5 -42.04 65.41 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.172 1.915 . . . . 0.0 113.398 -179.126 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.844 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.79 -43.26 69.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.18 0.514 . . . . 0.0 109.833 -179.067 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.722 HG12 HG12 ' A' ' 69' ' ' VAL . 0.4 OUTLIER -77.01 -15.57 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.06 177.901 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.645 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 4.9 tt0 -63.17 -35.08 79.11 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 177.101 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.26 -30.19 65.99 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.011 -0.995 . . . . 0.0 108.651 174.676 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.657 ' SD ' HG11 ' A' ' 69' ' ' VAL . 7.7 mtt -100.12 24.66 8.35 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.881 177.539 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.645 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -64.65 -31.46 5.68 Favored Pre-proline 0 CA--C 1.535 0.377 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.694 -178.213 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.555 ' CD ' ' N ' ' A' ' 36' ' ' HIS . 64.5 Cg_exo -38.61 -27.65 0.12 Allowed 'Trans proline' 0 C--N 1.363 1.313 0 C-N-CA 121.98 1.786 . . . . 0.0 111.9 178.244 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.825 HG22 HD13 ' A' ' 39' ' ' LEU . 13.6 m -77.66 -95.32 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 175.8 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.825 HD13 HG22 ' A' ' 38' ' ' THR . 2.2 mp -154.59 42.34 0.49 Allowed 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 177.662 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.531 ' HB1' ' HA ' ' A' ' 36' ' ' HIS . . . -42.19 105.99 0.05 Allowed 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 178.065 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.618 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . 170.49 -63.75 0.17 Allowed Glycine 0 N--CA 1.447 -0.576 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.883 -176.846 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.676 ' HE3' ' HG2' ' B' ' 12' ' ' GLU . 0.0 OUTLIER -77.86 -30.6 50.99 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.745 0.307 . . . . 0.0 110.658 178.773 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.769 HD13 ' HA ' ' A' ' 73' ' ' VAL . 60.0 mt -54.05 -62.22 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.244 -179.711 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.539 ' HA ' ' CD2' ' A' ' 28' ' ' LEU . 9.9 t -47.1 -41.14 16.69 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.185 -179.471 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.685 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -53.3 -63.71 4.83 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.854 178.769 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.67 ' HE3' HG21 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -55.63 -51.06 68.47 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.686 0.279 . . . . 0.0 111.476 -178.548 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.574 HD22 ' O ' ' A' ' 43' ' ' ILE . 2.3 mm? -78.67 4.8 12.64 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.772 -178.044 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.682 ' HB3' ' HD2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -66.25 -11.74 52.08 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.919 0.39 . . . . 0.0 110.62 179.371 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.428 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 3.2 mm-40 -74.64 13.5 0.61 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.265 177.605 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.56 HG21 ' HG2' ' A' ' 26' ' ' GLU . 0.1 OUTLIER -84.87 156.84 3.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.008 -179.66 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.437 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 1.1 m-20 -71.36 156.36 39.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.744 -179.817 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.518 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 3.1 m120 -82.41 -22.8 35.21 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 121.266 0.555 . . . . 0.0 109.598 176.423 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -74.61 -37.33 62.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.325 0.583 . . . . 0.0 109.794 176.807 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.07 -22.57 58.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.304 179.348 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.736 HD11 ' HB2' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -63.04 -48.17 79.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.882 178.56 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.514 ' O ' ' HG3' ' A' ' 60' ' ' GLU . 53.1 tp -55.28 -43.79 75.08 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.347 179.01 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -58.41 -41.17 84.34 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.056 179.226 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.505 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 24.4 mmt -60.12 -36.69 78.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.058 179.687 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.506 HD13 ' NE ' ' A' ' 27' ' ' ARG . 8.3 tt -70.9 -19.83 62.56 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.286 -179.19 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.514 ' HG3' ' O ' ' A' ' 56' ' ' LEU . 13.7 mt-10 -106.53 -3.72 20.52 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 -178.607 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.531 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.3 OUTLIER -122.52 83.08 47.44 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 120.602 0.239 . . . . 0.0 111.213 -179.447 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -59.94 -31.93 94.38 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.312 2.008 . . . . 0.0 111.945 179.237 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -78.09 -49.01 14.76 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.498 -179.793 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 47.4 m -70.58 -52.78 19.22 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.889 0.376 . . . . 0.0 111.439 -178.63 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.683 HD23 HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -57.93 -62.24 1.95 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.26 -178.704 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.541 ' HA ' ' HE2' ' A' ' 35' ' ' MET . 0.5 OUTLIER -50.71 -35.77 32.9 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.157 -177.831 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.595 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 4.2 m -67.96 -36.21 79.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.292 0.568 . . . . 0.0 110.049 178.127 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.58 ' HG2' HD22 ' B' ' 6' ' ' LEU . 9.7 ttpt -66.12 -57.67 7.15 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.11 178.556 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.775 ' HA ' ' HB3' ' A' ' 72' ' ' ALA . 42.0 t -65.21 -15.64 18.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.373 178.572 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.595 ' HB3' ' O ' ' A' ' 67' ' ' SER . 9.4 t70 -57.3 -48.98 77.55 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 176.313 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.434 ' O ' HG11 ' A' ' 75' ' ' VAL . 4.5 tt0 -68.6 -21.97 64.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.673 176.515 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.775 ' HB3' ' HA ' ' A' ' 69' ' ' VAL . . . -63.95 -51.17 65.62 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.817 179.597 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.769 ' HA ' HD13 ' A' ' 43' ' ' ILE . 2.6 m -56.15 -29.17 26.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 176.851 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.86 -32.47 69.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.055 178.64 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.67 HG21 ' HE3' ' A' ' 46' ' ' MET . 1.6 m -57.06 -33.48 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 178.515 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.734 HD13 ' HB2' ' A' ' 39' ' ' LEU . 39.0 mt -66.56 -48.3 70.1 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 175.96 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 17.1 mm100 -54.72 -36.79 65.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.315 178.916 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.89 -20.69 38.32 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.159 178.57 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.447 ' O ' ' HB3' ' A' ' 83' ' ' GLU . 12.1 t-80 -59.08 -68.82 0.23 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.902 -179.381 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.46 ' O ' ' HB2' ' A' ' 84' ' ' ALA . 31.2 mt-30 -63.55 -9.12 11.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.214 -179.755 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.55 -69.43 0.58 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.426 -179.67 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.1 -23.54 64.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.427 -178.95 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.447 ' HB3' ' O ' ' A' ' 79' ' ' HIS . 1.4 tt0 -74.66 -47.48 31.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.89 -179.577 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.46 ' HB2' ' O ' ' A' ' 80' ' ' GLN . . . -79.95 -4.94 54.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.079 -179.939 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -73.7 -43.91 57.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.206 -179.879 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -82.11 -28.29 32.34 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.002 -179.683 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.13 8.36 8.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.955 -179.871 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -88.85 44.72 1.23 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.015 179.924 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -97.73 126.87 50.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.044 -179.983 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 32.5 m-20 -96.6 7.27 46.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.037 -179.97 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 99.6 p -79.15 -5.14 53.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.864 179.837 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.45 -18.52 63.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.114 -179.918 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.65 158.22 17.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.0 -179.987 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -80.8 92.45 1.44 Allowed Glycine 0 N--CA 1.451 -0.367 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.426 179.817 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.411 ' HA ' ' HD3' ' A' ' 96' ' ' PRO . 31.6 m -104.96 149.19 37.29 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 120.576 0.227 . . . . 0.0 111.159 -179.738 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 95' ' ' VAL . 22.4 Cg_exo -65.26 -160.58 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.687 2.258 . . . . 0.0 112.361 -179.841 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 75.5 p -85.16 -174.85 5.46 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.865 179.885 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 15.6 m . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.172 -0.918 . . . . 0.0 111.095 -179.947 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.907 0.384 . . . . 0.0 111.008 . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 25.6 m -94.21 157.46 3.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.167 -179.975 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 9.0 mttm -93.83 94.3 8.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.013 -179.954 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 4' ' ' SER . . . . . 0.511 ' HB3' ' O ' ' B' ' 7' ' ' ASN . 9.3 t -73.72 -178.12 3.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.824 179.717 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 5' ' ' ASN . . . . . 0.411 ' HB3' ' HG2' ' A' ' 71' ' ' GLU . 0.3 OUTLIER -106.05 -52.66 2.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.029 -179.809 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.58 HD22 ' HG2' ' A' ' 68' ' ' LYS . 1.4 tp -74.45 -77.85 0.11 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.014 -179.75 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . 0.541 HD21 ' H ' ' B' ' 9' ' ' ASN . 2.1 t30 -83.71 138.33 40.88 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.026 179.867 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . 0.473 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 5.6 Cg_exo -79.86 -7.78 14.44 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.75 2.3 . . . . 0.0 111.928 179.234 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 9' ' ' ASN . . . . . 0.56 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 64.8 m-20 -123.38 56.31 1.2 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.185 -179.76 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . 0.555 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.8 98.94 0.08 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.707 179.507 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.56 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.0 OUTLIER -124.99 156.47 38.05 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.471 178.446 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . 0.676 ' HG2' ' HE3' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -56.25 166.49 0.82 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.764 0.316 . . . . 0.0 111.416 -179.656 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' B' B ' 13' ' ' PHE . . . . . 0.685 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.1 t80 -88.67 64.15 7.23 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.681 179.84 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . 0.562 ' N ' ' CD ' ' B' ' 15' ' ' PRO . 1.3 t -131.53 33.31 0.24 Allowed Pre-proline 0 CA--C 1.539 0.544 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 178.322 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 15' ' ' PRO . . . . . 0.734 ' HG3' ' HB2' ' B' ' 19' ' ' TYR . 31.8 Cg_endo -58.25 -34.11 98.27 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 122.278 1.985 . . . . 0.0 113.123 179.599 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.76 -43.11 3.19 Favored Glycine 0 N--CA 1.449 -0.468 0 N-CA-C 110.864 -0.894 . . . . 0.0 110.864 -175.27 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.507 ' O ' ' HG3' ' A' ' 21' ' ' LYS . 21.4 m -116.73 -172.26 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 176.588 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.537 ' HG3' ' NE2' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -60.17 104.96 0.36 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.812 0.339 . . . . 0.0 110.849 179.385 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.734 ' HB2' ' HG3' ' B' ' 15' ' ' PRO . 0.2 OUTLIER -79.47 131.31 36.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.936 -179.86 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 86.68 10.4 73.08 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.543 -179.946 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -101.26 -17.07 16.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.839 0.352 . . . . 0.0 110.915 179.972 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 11.3 mm . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.247 -0.882 . . . . 0.0 111.108 -179.974 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.24 0 N-CA-C 112.516 -0.234 . . . . 0.0 112.516 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -63.86 101.75 0.34 Allowed 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.6 2.2 . . . . 0.0 112.282 179.947 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -93.72 26.67 3.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.932 179.904 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.77 33.25 4.25 Favored Glycine 0 N--CA 1.453 -0.22 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.42 179.946 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.66 -50.52 0.31 Allowed Pre-proline 0 C--N 1.33 -0.276 0 N-CA-C 111.521 0.193 . . . . 0.0 111.521 179.84 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_exo -67.7 82.26 0.43 Allowed 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.326 2.017 . . . . 0.0 112.341 -179.502 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.469 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.2 OUTLIER -100.02 108.32 20.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.412 179.169 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.74 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 5.8 t -87.9 -32.03 19.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.886 -178.513 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.488 ' N ' HG22 ' A' ' 8' ' ' THR . . . -59.23 -33.66 71.28 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 177.707 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -75.09 -34.98 61.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.94 177.574 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.743 ' HE2' ' HA ' ' A' ' 23' ' ' MET . 9.0 mtm -64.42 -36.78 85.28 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.898 177.869 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.605 HD12 ' HB3' ' A' ' 24' ' ' LEU . 1.2 mp -52.59 -56.28 16.39 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.906 178.626 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.29 -25.27 66.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.881 178.202 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.6 m -101.61 23.7 10.83 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.834 -178.534 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.568 ' HB1' ' HB2' ' A' ' 19' ' ' GLU . . . -134.45 58.07 27.37 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.753 -0.203 . . . . 0.0 111.161 179.545 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.53 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 52.6 Cg_exo -53.88 -49.62 16.53 Favored 'Trans proline' 0 CA--C 1.537 0.625 0 C-N-CA 122.612 2.208 . . . . 0.0 113.626 -178.768 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.53 ' HD3' ' HB2' ' A' ' 16' ' ' PRO . 16.5 Cg_exo -68.32 -166.73 0.15 Allowed 'Trans proline' 0 C--N 1.355 0.887 0 C-N-CA 122.095 1.863 . . . . 0.0 112.198 -179.523 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -73.8 70.72 1.44 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.72 179.265 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.568 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 1.9 mm-40 -104.01 7.27 36.53 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.886 -179.47 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.577 HE22 ' HG3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -46.43 -61.0 2.0 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.223 -177.73 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.661 ' HD2' ' HA ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER -56.32 -25.02 47.44 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.293 -179.32 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.481 ' OE1' ' HG3' ' A' ' 23' ' ' MET . 2.9 tt0 -73.44 -75.56 0.14 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.844 0.354 . . . . 0.0 111.52 179.468 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.743 ' HA ' ' HE2' ' A' ' 11' ' ' MET . 0.0 OUTLIER -69.15 -96.58 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -176.309 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.608 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -61.96 0.73 0.35 Allowed 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 -175.532 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 65.0 -117.29 10.11 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 108.421 -1.872 . . . . 0.0 108.421 -174.322 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.788 ' HG3' HD23 ' A' ' 55' ' ' LEU . 1.2 mp0 -75.91 -68.54 0.57 Allowed 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 169.401 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.814 ' HG2' HD23 ' A' ' 59' ' ' LEU . 1.7 tpt180 -160.06 11.75 0.12 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.216 175.537 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.604 ' HA ' HD12 ' A' ' 31' ' ' LEU . 4.1 mm? -57.2 -78.45 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.608 -1.178 . . . . 0.0 113.49 -173.302 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.624 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -35.05 -48.33 1.04 Allowed Pre-proline 0 CA--C 1.539 0.521 0 N-CA-C 113.642 0.978 . . . . 0.0 113.642 -175.517 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.542 ' HG2' ' HD2' ' A' ' 27' ' ' ARG . 46.8 Cg_exo -59.69 -42.16 49.11 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 122.367 2.045 . . . . 0.0 113.736 -178.204 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.604 HD12 ' HA ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -70.61 -44.54 67.06 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 121.131 0.491 . . . . 0.0 109.97 -178.474 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.604 HG12 HG12 ' A' ' 69' ' ' VAL . 0.2 OUTLIER -76.9 -13.0 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.968 178.179 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.606 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 49.6 tp60 -62.33 -37.47 85.72 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 176.75 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.47 -32.5 71.46 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.139 174.749 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.589 ' SD ' HG11 ' A' ' 69' ' ' VAL . 7.0 mtt -100.13 28.75 4.68 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.203 177.85 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.606 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.2 OUTLIER -63.16 -32.15 8.1 Favored Pre-proline 0 CA--C 1.535 0.402 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -177.429 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.548 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 60.0 Cg_exo -36.65 -32.85 0.13 Allowed 'Trans proline' 0 C--N 1.362 1.275 0 C-N-CA 122.083 1.855 . . . . 0.0 112.27 179.23 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 86.6 m -78.26 -88.08 0.05 Allowed 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.8 176.836 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.66 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 0.1 OUTLIER -171.35 61.17 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.447 178.203 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.458 ' HB3' ' O ' ' A' ' 32' ' ' ILE . . . -44.99 -34.24 2.36 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.848 0.356 . . . . 0.0 111.616 179.661 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.624 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -50.94 -58.16 9.88 Favored Glycine 0 C--N 1.33 0.243 0 CA-C-N 115.989 -0.551 . . . . 0.0 113.867 -178.995 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.443 ' HA ' ' HD3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -77.86 -34.35 51.74 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -177.867 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.675 HD13 ' HA ' ' A' ' 73' ' ' VAL . 36.1 mt -55.98 -55.43 18.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.715 -0.22 . . . . 0.0 111.481 -179.008 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.53 HG22 ' CD2' ' A' ' 29' ' ' PHE . 6.1 t -47.56 -44.18 25.91 Favored 'General case' 0 CA--C 1.522 -0.119 0 CA-C-O 121.006 0.432 . . . . 0.0 110.135 178.637 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.796 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -49.65 -65.39 2.85 Favored Glycine 0 N--CA 1.448 -0.501 0 CA-C-N 115.312 -0.858 . . . . 0.0 113.464 -179.862 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.736 ' HE1' HG21 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -55.33 -50.72 68.88 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -177.276 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.48 ' HA ' HD12 ' A' ' 47' ' ' LEU . 2.9 mm? -79.06 6.2 10.04 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -177.917 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.553 ' O ' HD12 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -66.21 -7.65 19.55 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.984 0.421 . . . . 0.0 110.622 179.195 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.435 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 3.3 mt-10 -81.96 16.8 1.75 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.664 178.437 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.403 HG21 ' HG2' ' A' ' 26' ' ' GLU . 0.5 OUTLIER -83.16 158.82 3.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.816 -179.514 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -70.59 160.05 33.23 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.02 0.438 . . . . 0.0 111.838 -178.089 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.539 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 4.9 m120 -83.67 -31.39 26.17 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.448 178.738 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.1 t -74.01 -34.27 64.1 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.387 0.613 . . . . 0.0 109.523 177.516 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.443 ' HG3' ' N ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -75.58 -28.65 59.03 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.645 179.367 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.788 HD23 ' HG3' ' A' ' 26' ' ' GLU . 0.7 OUTLIER -59.34 -47.07 86.79 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 120.923 0.392 . . . . 0.0 110.003 179.124 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.75 ' HA ' HD21 ' A' ' 59' ' ' LEU . 2.2 tm? -56.33 -48.04 77.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.926 -179.844 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.428 ' O ' ' HB2' ' A' ' 61' ' ' SER . 15.4 t60 -58.05 -24.67 59.33 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.918 -179.119 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.582 ' HE1' ' HA ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -73.86 -58.17 3.48 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -177.542 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.814 HD23 ' HG2' ' A' ' 27' ' ' ARG . 2.2 pt? -65.59 -6.03 9.9 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.962 -179.024 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.518 ' HG3' HD11 ' A' ' 56' ' ' LEU . 13.4 mm-40 -106.68 -10.86 15.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.679 177.455 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.568 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.5 OUTLIER -122.5 97.83 44.3 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.137 179.75 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -64.06 -30.53 66.07 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.201 1.934 . . . . 0.0 112.028 179.07 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -78.22 -51.26 10.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.599 -179.7 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.435 ' HB3' ' HB3' ' A' ' 61' ' ' SER . 33.2 t -69.07 -44.65 72.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.686 -178.033 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.582 ' HA ' ' HE1' ' A' ' 58' ' ' MET . 0.2 OUTLIER -69.86 -62.14 1.5 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.986 -177.136 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.419 ' O ' ' HB2' ' A' ' 70' ' ' ASP . 0.0 OUTLIER -51.15 -29.28 13.13 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.962 -177.646 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.456 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.4 OUTLIER -69.59 -39.53 77.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.138 0.494 . . . . 0.0 110.233 178.013 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.412 ' HE3' ' OE2' ' A' ' 54' ' ' GLU . 5.0 mtmm -65.49 -61.05 2.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.236 178.862 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.81 ' HA ' ' HB3' ' A' ' 72' ' ' ALA . 53.0 t -61.78 -20.95 24.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.942 -179.416 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.595 ' O ' HG23 ' A' ' 73' ' ' VAL . 16.5 t70 -54.63 -51.76 64.39 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 176.458 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.444 ' O ' HG13 ' A' ' 75' ' ' VAL . 0.5 OUTLIER -69.23 -26.3 64.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.017 177.003 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.81 ' HB3' ' HA ' ' A' ' 69' ' ' VAL . . . -61.17 -48.2 82.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.04 179.952 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.675 ' HA ' HD13 ' A' ' 43' ' ' ILE . 2.6 m -58.48 -31.58 43.66 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 177.541 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.418 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -68.16 -37.92 81.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.145 178.952 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.736 HG21 ' HE1' ' A' ' 46' ' ' MET . 1.0 OUTLIER -60.61 -31.17 48.38 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.217 0 CA-C-O 120.919 0.39 . . . . 0.0 110.225 179.511 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.66 ' HG ' ' HB3' ' A' ' 39' ' ' LEU . 2.3 tm? -71.41 -49.54 40.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.215 178.803 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 9.7 mm100 -57.62 -37.64 73.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.457 179.214 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.29 -21.78 39.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.905 -0.588 . . . . 0.0 111.067 179.293 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.492 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 11.9 t-80 -59.74 -53.13 61.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.025 -179.534 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -73.7 -7.03 50.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.088 -179.812 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.67 -54.76 5.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.49 -179.592 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 5.5 mmtp -78.6 -23.82 45.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.41 -178.975 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.492 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 1.5 tt0 -77.09 -34.98 56.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.19 -179.575 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -72.46 -27.42 62.29 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.075 -179.779 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.22 -72.05 0.17 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.061 179.928 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -87.83 133.37 33.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.918 179.934 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.87 57.21 2.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.842 179.976 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -81.39 6.5 14.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.104 179.864 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -97.89 169.66 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.962 179.844 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.82 37.36 1.3 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.951 -179.937 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.5 p -77.46 -10.13 59.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.942 -179.993 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.01 165.68 24.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.024 179.839 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -95.25 -35.21 11.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.942 179.981 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -104.66 96.13 1.21 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.547 -179.809 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 12.5 t -93.41 118.89 67.7 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 120.598 0.237 . . . . 0.0 111.032 -179.942 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -57.95 147.77 80.1 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.53 2.154 . . . . 0.0 112.139 179.913 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -81.98 153.82 26.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.904 -179.908 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.6 m . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.105 -0.95 . . . . 0.0 111.141 179.924 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 17.2 m . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.829 0.347 . . . . 0.0 110.992 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 23.8 m -90.12 -178.69 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.155 -179.89 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 2.5 pttp -85.71 146.32 26.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.953 -179.901 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 4' ' ' SER . . . . . 0.574 ' HB2' ' HB3' ' B' ' 10' ' ' ALA . 7.6 t -87.32 -161.72 0.72 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.929 -179.822 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -103.57 -50.79 3.34 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.237 179.117 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.447 ' HB3' HD13 ' A' ' 47' ' ' LEU . 7.5 tp -68.87 -77.53 0.08 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.112 178.182 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . 0.452 ' HA ' ' HD3' ' B' ' 8' ' ' PRO . 1.1 t30 -92.08 127.6 48.72 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.327 177.768 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 6.6 Cg_exo -73.77 -2.12 11.76 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.281 1.987 . . . . 0.0 112.177 -179.717 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 9' ' ' ASN . . . . . 0.403 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 8.3 m-20 -123.76 40.31 3.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.042 -179.774 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . 0.574 ' HB3' ' HB2' ' B' ' 4' ' ' SER . . . -53.1 92.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.508 -179.383 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.471 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -121.37 136.23 54.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.946 179.125 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -47.67 168.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -177.905 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 13' ' ' PHE . . . . . 0.796 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.6 OUTLIER -87.32 77.67 8.9 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.783 179.171 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . 0.758 ' H ' ' HD2' ' B' ' 15' ' ' PRO . 3.2 m -117.36 -33.19 0.08 OUTLIER Pre-proline 0 CA--C 1.54 0.595 0 N-CA-C 114.255 1.205 . . . . 0.0 114.255 -175.897 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 15' ' ' PRO . . . . . 0.758 ' HD2' ' H ' ' B' ' 14' ' ' VAL . 10.0 Cg_endo -52.4 -35.76 66.55 Favored 'Trans proline' 0 C--N 1.356 0.946 0 C-N-CA 121.772 1.648 . . . . 0.0 112.508 -178.672 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.52 -8.54 7.07 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.5 -179.767 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.661 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 27.5 m -108.49 -175.78 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.635 0.255 . . . . 0.0 110.627 179.822 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.577 ' HG3' HE22 ' A' ' 20' ' ' GLN . 1.8 mppt? -63.95 87.88 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.012 0.434 . . . . 0.0 110.556 179.804 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.471 ' CE2' ' HG2' ' B' ' 11' ' ' LYS . 0.2 OUTLIER -81.04 108.81 15.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.101 -178.922 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 90.5 47.31 3.79 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.445 -179.929 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 36.9 t30 -95.83 -30.66 13.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.892 0.377 . . . . 0.0 111.024 -179.798 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 17.6 mm . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.191 -0.909 . . . . 0.0 110.994 179.854 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.232 0 N-CA-C 112.409 -0.276 . . . . 0.0 112.409 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -59.63 94.97 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.575 2.183 . . . . 0.0 112.269 -179.838 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.2 tt -86.35 115.59 23.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.752 179.634 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.18 104.46 1.93 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.69 -0.766 . . . . 0.0 112.512 -179.724 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 70.7 m -81.61 111.38 25.27 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 120.595 0.236 . . . . 0.0 110.868 179.934 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.565 ' HG2' ' N ' ' A' ' 10' ' ' SER . 35.3 Cg_endo -65.42 -170.36 0.16 Allowed 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.602 2.202 . . . . 0.0 112.445 -179.769 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.425 ' O ' ' HG3' ' A' ' 11' ' ' MET . 22.3 mt -91.21 -78.12 0.4 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.227 -179.447 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.74 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 9.9 t -87.9 -31.28 19.55 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.559 -179.157 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.496 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.18 -36.57 75.56 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 177.175 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.565 ' N ' ' HG2' ' A' ' 6' ' ' PRO . 35.2 t -71.4 -34.19 70.15 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.625 177.003 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.74 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 5.3 mtm -64.32 -34.31 77.84 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 177.347 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.617 HD11 ' SD ' ' A' ' 23' ' ' MET . 3.4 mp -52.54 -52.61 53.97 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.902 178.481 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.09 -25.51 67.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.895 178.414 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.6 p -101.93 13.23 35.37 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.846 -178.676 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.563 ' HB3' ' O ' ' A' ' 11' ' ' MET . . . -134.33 57.85 26.29 Favored Pre-proline 0 CA--C 1.534 0.339 0 CA-C-O 120.528 0.204 . . . . 0.0 111.29 -179.871 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.506 ' HD3' ' N ' ' A' ' 15' ' ' ALA . 49.4 Cg_exo -58.47 -49.22 12.61 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 122.725 2.283 . . . . 0.0 114.181 -178.272 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.465 ' HD2' ' N ' ' A' ' 16' ' ' PRO . 37.8 Cg_endo -66.22 -158.48 0.04 OUTLIER 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 122.063 1.842 . . . . 0.0 112.746 -178.283 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -73.67 64.68 0.93 Allowed 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.873 179.921 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.574 ' HB3' ' HE1' ' A' ' 23' ' ' MET . 0.0 OUTLIER -104.47 9.88 35.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.676 -179.933 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -47.07 -67.27 0.29 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.521 -179.14 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.789 ' HE3' ' HA ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER -55.79 -21.21 18.12 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.814 -177.706 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.578 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 10.3 tt0 -73.52 -78.32 0.1 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.006 0.431 . . . . 0.0 111.254 179.177 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.617 ' SD ' HD11 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.25 -95.99 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -176.909 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.65 HD11 HH11 ' A' ' 27' ' ' ARG . 0.3 OUTLIER -61.63 -1.32 0.56 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -175.323 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.588 ' O ' HD21 ' A' ' 24' ' ' LEU . . . 64.38 -117.41 10.61 Favored Glycine 0 CA--C 1.505 -0.569 0 N-CA-C 108.262 -1.935 . . . . 0.0 108.262 -174.6 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.42 ' HG3' ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -76.45 -67.59 0.68 Allowed 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 107.143 -1.428 . . . . 0.0 107.143 168.049 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.65 HH11 HD11 ' A' ' 24' ' ' LEU . 1.6 tpt180 -159.71 10.54 0.12 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 114.364 -1.289 . . . . 0.0 108.614 175.302 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.745 ' HA ' HD12 ' A' ' 31' ' ' LEU . 3.8 mm? -56.91 -84.84 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.655 -1.157 . . . . 0.0 113.929 -172.924 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.569 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -31.14 -51.09 0.43 Allowed Pre-proline 0 CA--C 1.539 0.535 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -174.833 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.61 ' HG2' ' HB2' ' A' ' 24' ' ' LEU . 54.1 Cg_exo -56.43 -42.75 62.37 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 122.238 1.959 . . . . 0.0 113.875 -178.178 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.745 HD12 ' HA ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -71.12 -44.06 66.38 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.112 0.482 . . . . 0.0 110.375 -178.232 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.786 HD11 ' HB ' ' A' ' 43' ' ' ILE . 0.0 OUTLIER -72.55 -20.64 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.708 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.127 179.254 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 62.8 tp60 -62.79 -31.45 72.43 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 175.684 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.33 -20.14 55.34 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 114.99 -1.004 . . . . 0.0 109.984 176.942 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.589 ' HG3' ' HA ' ' A' ' 32' ' ' ILE . 2.5 mtt -98.49 7.06 46.65 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.117 178.679 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -77.29 163.46 64.45 Favored Pre-proline 0 N--CA 1.447 -0.621 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.427 -179.75 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -100.85 90.05 0.08 OUTLIER 'Cis proline' 0 C--N 1.353 0.769 0 C-N-CA 124.535 -1.027 . . . . 0.0 113.49 4.078 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 6.5 m -98.99 -70.36 0.73 Allowed 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 176.163 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.591 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 2.9 tp -171.76 28.62 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.157 176.887 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.581 ' HB2' ' HB ' ' A' ' 32' ' ' ILE . . . -33.6 -38.96 0.05 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.046 -179.272 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.569 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -52.26 -53.0 33.3 Favored Glycine 0 C--N 1.33 0.238 0 C-N-CA 121.052 -0.594 . . . . 0.0 113.048 179.61 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.514 ' HD2' ' HG2' ' B' ' 12' ' ' GLU . 0.0 OUTLIER -78.16 -34.14 49.9 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 122.676 -0.308 . . . . 0.0 111.427 -179.725 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.786 ' HB ' HD11 ' A' ' 32' ' ' ILE . 1.8 mt -54.14 -57.98 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-O 120.583 0.23 . . . . 0.0 110.789 179.979 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.497 HG21 ' N ' ' A' ' 45' ' ' GLY . 10.0 t -47.76 -46.03 29.73 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.078 178.558 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.559 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -50.15 -66.49 2.32 Favored Glycine 0 N--CA 1.449 -0.462 0 CA-C-N 115.608 -0.724 . . . . 0.0 113.214 179.838 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.527 ' HB2' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.47 -51.68 66.14 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -177.648 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.515 ' N ' HD21 ' A' ' 47' ' ' LEU . 2.8 mm? -79.35 8.33 6.33 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -177.975 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.559 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.13 -6.82 14.57 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.08 0.467 . . . . 0.0 110.334 178.676 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.465 ' OE2' ' HB3' ' B' ' 11' ' ' LYS . 3.3 mt-10 -81.66 16.06 1.91 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.607 178.698 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.744 HD12 ' NZ ' ' A' ' 68' ' ' LYS . 0.9 OUTLIER -83.18 160.25 3.58 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.633 -179.729 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.519 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 34.4 m-20 -70.99 154.98 41.36 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.97 0.414 . . . . 0.0 112.036 -178.16 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.495 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 1.1 t-20 -82.99 -31.08 27.72 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.034 177.995 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.2 t -73.97 -33.46 63.87 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.344 0.592 . . . . 0.0 109.477 177.592 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.519 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -75.38 -27.82 59.25 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.467 179.074 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.512 ' CD1' ' HB2' ' A' ' 27' ' ' ARG . 0.6 OUTLIER -59.64 -47.82 84.08 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.189 179.432 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.423 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 12.2 tp -56.54 -46.27 80.76 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.623 179.361 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -59.75 -32.67 70.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.28 179.882 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.515 ' SD ' ' HE2' ' A' ' 68' ' ' LYS . 32.0 mmt -60.87 -51.61 68.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.432 -179.4 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.597 HD23 ' NE ' ' A' ' 27' ' ' ARG . 0.2 OUTLIER -61.61 -22.23 65.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.081 -179.057 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -99.75 -3.64 32.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.8 179.954 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.572 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 16.0 m -122.72 80.64 48.57 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.52 179.617 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.37 -35.69 95.97 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.147 1.898 . . . . 0.0 111.996 179.85 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.586 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.67 -45.19 21.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.718 -179.466 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.586 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 7.0 m -70.47 -51.98 25.27 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.952 0.406 . . . . 0.0 111.33 -178.079 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.618 HD21 HD23 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -58.12 -61.06 2.83 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.672 -178.755 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.614 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 1.1 ttp180 -48.39 -33.33 8.95 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.221 -177.436 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.424 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 8.2 t -61.67 -44.23 97.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.118 0.485 . . . . 0.0 110.277 178.307 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.744 ' NZ ' HD12 ' A' ' 50' ' ' ILE . 13.6 mtpp -65.92 -63.03 1.18 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.806 179.451 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.738 ' HA ' ' HB1' ' A' ' 72' ' ' ALA . 55.2 t -58.77 -19.45 14.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.089 -179.496 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.576 ' O ' HG23 ' A' ' 73' ' ' VAL . 20.4 t70 -58.19 -48.89 78.91 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 175.709 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.431 ' O ' HG11 ' A' ' 75' ' ' VAL . 3.5 tt0 -69.03 -27.23 65.48 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.817 176.603 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.78 ' HA ' HG13 ' A' ' 75' ' ' VAL . . . -60.31 -54.39 46.31 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.178 179.485 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.648 ' HA ' HD12 ' A' ' 43' ' ' ILE . 3.3 m -55.08 -29.62 22.65 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 177.932 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.57 -36.37 65.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.618 179.794 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.78 HG13 ' HA ' ' A' ' 72' ' ' ALA . 1.1 m -56.26 -31.17 31.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 N-CA-C 109.713 -0.476 . . . . 0.0 109.713 179.493 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.645 HD23 HG12 ' A' ' 43' ' ' ILE . 4.4 mm? -72.21 -48.69 41.08 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.861 176.552 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 34.9 mm-40 -50.82 -34.38 27.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.316 177.906 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -82.18 -29.7 31.35 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.55 176.911 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.564 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 16.4 t-80 -61.25 -42.24 98.28 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.979 -179.913 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -71.91 -25.45 61.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.964 0.411 . . . . 0.0 110.466 178.902 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -73.64 -45.18 54.33 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.629 179.242 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.551 ' HD3' ' HG3' ' B' ' 3' ' ' LYS . 0.0 OUTLIER -76.25 -19.43 58.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.23 178.788 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.564 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 8.0 tt0 -74.22 -48.58 27.95 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.123 178.689 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.03 -46.9 87.98 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 176.479 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.402 ' C ' ' H ' ' A' ' 87' ' ' LYS . . . -85.41 59.79 5.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.364 176.911 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.52 7.78 1.71 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.575 -178.21 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.402 ' H ' ' C ' ' A' ' 85' ' ' ALA . 0.3 OUTLIER -73.68 110.36 7.91 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.478 179.368 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.32 85.34 0.4 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.284 -178.971 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.457 HG13 ' H ' ' A' ' 91' ' ' SER . 20.9 t -93.96 115.48 32.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.967 179.632 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -89.15 4.94 46.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.944 -179.738 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.457 ' H ' HG13 ' A' ' 89' ' ' VAL . 22.8 t -81.1 -20.79 40.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.937 179.98 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -91.79 111.23 22.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.026 179.984 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -115.08 154.63 28.54 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.953 -179.902 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -88.15 -158.96 34.07 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.494 -179.958 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.546 ' HB ' ' HD3' ' A' ' 96' ' ' PRO . 18.6 t -105.2 -52.73 0.1 Allowed Pre-proline 0 C--N 1.329 -0.324 0 N-CA-C 111.607 0.225 . . . . 0.0 111.607 -179.701 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.546 ' HD3' ' HB ' ' A' ' 95' ' ' VAL . 71.8 Cg_endo -77.75 102.63 1.61 Allowed 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.154 1.903 . . . . 0.0 112.416 -179.853 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 60.3 p -105.56 133.18 50.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.895 179.85 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 16.5 m . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.114 -0.946 . . . . 0.0 111.029 179.848 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 27.6 m . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.752 0.311 . . . . 0.0 111.042 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 15.5 m -88.56 172.49 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.149 -179.824 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . 0.551 ' HG3' ' HD3' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -76.19 79.28 2.99 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.753 179.746 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.35 154.07 18.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.4 -179.18 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -108.67 -48.79 3.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.433 179.08 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.403 HD21 ' HB3' ' A' ' 68' ' ' LYS . 1.9 tp -64.8 -83.19 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.472 178.949 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . 0.494 ' HB2' HD13 ' A' ' 47' ' ' LEU . 0.4 OUTLIER -82.47 113.06 41.67 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.441 178.301 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -66.41 -5.05 11.84 Favored 'Trans proline' 0 N--CA 1.463 -0.296 0 C-N-CA 122.122 1.882 . . . . 0.0 112.242 -179.728 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 69.0 m-20 -123.74 38.52 4.17 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.465 179.139 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . 0.527 ' HB1' ' HB2' ' A' ' 46' ' ' MET . . . -53.91 94.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.87 -178.641 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.56 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -115.01 131.59 56.87 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.839 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . 0.514 ' HG2' ' HD2' ' A' ' 42' ' ' LYS . 6.7 mt-10 -50.0 178.97 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -177.204 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 13' ' ' PHE . . . . . 0.467 ' CE1' ' HG ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -86.9 79.92 8.62 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.853 179.725 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . 0.474 ' HB ' ' HD3' ' B' ' 15' ' ' PRO . 3.2 t -109.75 -49.94 0.07 OUTLIER Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 115.316 -0.857 . . . . 0.0 112.418 -177.319 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 15' ' ' PRO . . . . . 0.474 ' HD3' ' HB ' ' B' ' 14' ' ' VAL . 97.5 Cg_exo -44.82 -44.07 14.62 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 122.392 2.061 . . . . 0.0 112.829 -179.058 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 81.11 -30.47 2.67 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.652 -0.785 . . . . 0.0 112.483 -179.99 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.789 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 2.1 m -94.66 -174.55 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.496 0.189 . . . . 0.0 110.619 179.495 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.28 89.4 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.075 0.464 . . . . 0.0 110.974 -178.68 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.56 ' CE2' ' HG2' ' B' ' 11' ' ' LYS . 2.1 t80 -85.63 105.7 16.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.067 -179.511 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 85.11 60.95 1.78 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.495 179.893 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -95.18 -8.91 34.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.727 0.299 . . . . 0.0 110.935 -179.809 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 24.1 mm . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.203 -0.903 . . . . 0.0 111.076 179.973 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.127 0 N-CA-C 112.509 -0.237 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_exo -56.56 -46.03 32.9 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.576 2.184 . . . . 0.0 112.323 -179.885 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -94.45 25.6 3.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.872 -179.961 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -81.53 -25.24 54.55 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.634 -179.868 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.98 112.65 31.68 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 120.589 0.233 . . . . 0.0 110.889 -179.947 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_exo -62.41 87.03 0.11 Allowed 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.583 2.189 . . . . 0.0 112.288 -179.908 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.429 ' O ' ' HG3' ' A' ' 11' ' ' MET . 3.3 mt -100.87 114.11 27.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.912 179.916 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.746 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 9.8 t -87.89 -34.15 18.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.435 -179.685 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.426 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.22 -36.23 75.05 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 177.068 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 5.4 t -68.98 -35.74 77.06 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.746 177.101 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.746 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 5.4 mtm -64.39 -35.92 82.46 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.943 177.769 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.746 HD13 ' HB3' ' A' ' 24' ' ' LEU . 4.2 mp -52.31 -48.48 65.37 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.07 178.921 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.97 -30.17 70.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.836 178.312 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.468 ' HG ' ' HA ' ' A' ' 11' ' ' MET . 4.9 p -101.71 21.56 14.26 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.716 -179.012 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.605 ' HB2' ' O ' ' A' ' 11' ' ' MET . . . -134.51 59.13 34.16 Favored Pre-proline 0 CA--C 1.532 0.277 0 CA-C-O 120.555 0.217 . . . . 0.0 111.319 179.875 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.511 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 52.5 Cg_exo -56.26 -49.35 15.46 Favored 'Trans proline' 0 CA--C 1.537 0.671 0 C-N-CA 122.631 2.221 . . . . 0.0 113.873 -178.706 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.511 ' HD3' ' HB2' ' A' ' 16' ' ' PRO . 23.7 Cg_exo -65.31 -162.7 0.05 OUTLIER 'Trans proline' 0 C--N 1.354 0.853 0 C-N-CA 122.272 1.981 . . . . 0.0 112.73 -178.488 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -74.48 52.8 0.51 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.216 179.508 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.534 ' O ' ' HB3' ' A' ' 22' ' ' GLN . 2.1 mm-40 -86.6 11.09 13.6 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.727 179.97 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.531 HE22 ' HG2' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -46.04 -70.1 0.11 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.122 -179.078 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.481 ' HB2' ' O ' ' B' ' 16' ' ' GLY . 0.0 OUTLIER -55.6 -18.59 7.99 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.651 -177.668 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.534 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 10.8 tp60 -73.95 -79.22 0.09 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.909 0.385 . . . . 0.0 111.457 178.223 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.647 ' HA ' ' HE1' ' A' ' 11' ' ' MET . 0.0 OUTLIER -69.17 -94.9 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.984 -0.553 . . . . 0.0 112.412 -176.775 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.746 ' HB3' HD13 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -59.45 0.52 0.12 Allowed 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -176.588 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.482 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.36 -118.85 13.69 Favored Glycine 0 CA--C 1.501 -0.84 0 N-CA-C 107.979 -2.048 . . . . 0.0 107.979 -174.384 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.508 ' HG2' HD21 ' A' ' 52' ' ' ASN . 29.0 mt-10 -77.26 -66.01 0.88 Allowed 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 167.659 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.763 ' HB2' HD13 ' A' ' 55' ' ' LEU . 2.5 tpt180 -160.22 9.51 0.1 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.095 -1.411 . . . . 0.0 108.472 174.76 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.876 HD13 ' HA ' ' A' ' 44' ' ' THR . 3.6 mm? -56.99 -80.42 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.732 -1.122 . . . . 0.0 113.681 -172.978 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.42 ' HA ' ' HG1' ' A' ' 44' ' ' THR . 0.1 OUTLIER -34.82 -48.71 1.01 Allowed Pre-proline 0 CA--C 1.538 0.505 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -174.445 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.648 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 50.5 Cg_exo -57.95 -42.85 54.1 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.15 1.9 . . . . 0.0 113.573 -178.972 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.625 HD22 HD12 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -71.86 -47.4 53.26 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.664 -178.328 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.605 ' HA ' ' HG3' ' A' ' 35' ' ' MET . 0.0 OUTLIER -69.76 -18.22 21.91 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 C-N-CA 120.614 -0.434 . . . . 0.0 109.938 178.86 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.463 ' HB3' ' O ' ' A' ' 30' ' ' PRO . 36.4 tp60 -62.88 -34.14 76.76 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 174.136 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -74.16 -19.12 60.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 114.775 -1.102 . . . . 0.0 110.128 176.816 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.605 ' HG3' ' HA ' ' A' ' 32' ' ' ILE . 0.1 OUTLIER -98.66 -3.42 36.08 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.892 178.22 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.451 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -62.51 166.05 7.98 Favored Pre-proline 0 N--CA 1.448 -0.568 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.247 -179.951 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.416 ' HA ' ' CB ' ' A' ' 36' ' ' HIS . 69.6 Cg_endo -103.7 61.3 0.62 Allowed 'Cis proline' 0 N--CA 1.455 -0.747 0 C-N-CA 124.69 -0.962 . . . . 0.0 113.959 5.158 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 52.7 m -77.04 -73.8 0.28 Allowed 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 176.793 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.713 ' HB2' HD22 ' A' ' 76' ' ' LEU . 0.2 OUTLIER -171.95 49.5 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.848 176.428 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.497 ' CB ' ' HB ' ' A' ' 32' ' ' ILE . . . -41.47 -34.63 0.57 Allowed 'General case' 0 N--CA 1.462 0.13 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.582 179.907 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -54.3 -71.99 0.62 Allowed Glycine 0 N--CA 1.452 -0.28 0 CA-C-N 116.083 -0.508 . . . . 0.0 113.692 -179.207 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.527 ' O ' ' HG2' ' A' ' 46' ' ' MET . 0.0 OUTLIER -57.57 -41.85 81.91 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -177.074 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.485 ' HB ' HD13 ' A' ' 32' ' ' ILE . 22.7 mt -53.31 -57.4 4.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 121.079 0.466 . . . . 0.0 110.195 179.262 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.876 ' HA ' HD13 ' A' ' 28' ' ' LEU . 1.3 m -47.64 -45.78 28.19 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.247 177.475 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.727 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -51.25 -60.7 6.92 Favored Glycine 0 N--CA 1.445 -0.71 0 CA-C-N 115.06 -0.973 . . . . 0.0 113.231 -179.623 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.555 ' HB3' ' HB2' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -54.41 -59.47 4.65 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.746 0.307 . . . . 0.0 111.779 -177.473 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.705 HD23 ' HB2' ' B' ' 7' ' ' ASN . 1.1 mp -79.9 18.23 0.84 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.162 0.431 . . . . 0.0 112.162 -176.742 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.578 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.01 -6.94 14.42 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.301 0.572 . . . . 0.0 109.582 175.659 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.494 ' OE1' ' HB3' ' B' ' 9' ' ' ASN . 2.6 mt-10 -93.24 25.35 3.37 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.756 179.462 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.501 HD12 ' NZ ' ' A' ' 68' ' ' LYS . 3.5 tt -83.0 176.23 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.782 -179.72 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.722 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 7.0 m-20 -73.53 124.47 25.94 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.705 0.261 . . . . 0.0 111.705 179.441 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.657 ' HA ' HD21 ' A' ' 55' ' ' LEU . 3.7 t-20 -66.14 -30.54 71.05 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.448 0.642 . . . . 0.0 109.722 177.521 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.6 m -73.31 -33.19 65.03 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.838 177.612 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.722 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 3.9 mm-40 -76.96 -24.4 52.31 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.449 178.81 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.763 HD13 ' HB2' ' A' ' 27' ' ' ARG . 0.6 OUTLIER -59.08 -47.93 83.46 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 179.515 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.465 HD21 ' HA ' ' A' ' 56' ' ' LEU . 0.3 OUTLIER -59.45 -42.33 91.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.779 178.174 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.496 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 26.6 m-70 -69.27 -19.03 63.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.243 179.321 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.535 ' HG2' ' O ' ' A' ' 54' ' ' GLU . 23.8 mmt -68.66 -58.97 3.48 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.053 -179.576 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.707 HD11 ' NE ' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -61.51 -21.02 63.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.103 -179.577 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.496 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 0.6 OUTLIER -91.62 -9.57 43.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.085 179.817 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.54 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.5 OUTLIER -122.92 85.25 50.41 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.799 179.696 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_exo -59.88 -33.52 95.85 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.398 2.065 . . . . 0.0 112.292 -179.666 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.644 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.22 -45.8 22.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.297 -179.395 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.644 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 10.7 m -70.62 -54.16 13.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.83 0.348 . . . . 0.0 111.328 -178.695 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.625 HD12 HD22 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -57.82 -61.99 2.13 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.866 -178.286 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.624 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -48.53 -35.29 12.92 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.055 -177.256 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.15 -44.01 97.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.155 0.502 . . . . 0.0 110.154 178.45 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.501 ' NZ ' HD12 ' A' ' 50' ' ' ILE . 29.4 mtpt -66.3 -62.21 1.6 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.114 179.619 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.819 ' HA ' ' HB3' ' A' ' 72' ' ' ALA . 45.4 t -59.8 -21.29 21.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.187 -178.871 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.485 ' O ' HG21 ' A' ' 73' ' ' VAL . 18.5 t70 -58.34 -48.52 80.31 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 176.412 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.49 ' O ' ' HB2' ' A' ' 74' ' ' ALA . 0.8 OUTLIER -69.04 -25.61 64.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.597 176.557 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.819 ' HB3' ' HA ' ' A' ' 69' ' ' VAL . . . -62.2 -53.15 59.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.015 -179.908 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.485 HG21 ' O ' ' A' ' 70' ' ' ASP . 11.1 m -57.41 -26.28 26.0 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 177.684 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.49 ' HB2' ' O ' ' A' ' 71' ' ' GLU . . . -73.18 -36.84 66.64 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.187 178.618 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.616 HG11 ' HA ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.04 -37.65 62.71 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.147 0 CA-C-O 120.896 0.379 . . . . 0.0 110.051 179.458 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.713 HD22 ' HB2' ' A' ' 39' ' ' LEU . 0.5 OUTLIER -71.8 -43.11 66.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.081 177.961 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 54.7 mm-40 -52.85 -38.51 61.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.732 178.624 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.69 -26.02 35.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.302 177.151 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.498 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 18.2 t60 -68.06 -32.17 72.33 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.039 -179.886 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.404 ' NE2' HD23 ' A' ' 76' ' ' LEU . 0.5 OUTLIER -83.28 -11.25 57.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.006 -179.959 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -76.36 -63.33 1.36 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.184 -179.656 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 29.8 mttt -68.65 -14.11 62.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.14 -179.561 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.498 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 10.9 tt0 -91.12 -19.87 22.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.92 0.391 . . . . 0.0 110.807 179.6 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -68.5 -9.75 51.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.068 179.809 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.62 -43.67 96.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.962 179.949 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -83.5 -68.51 0.7 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.833 179.7 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -94.83 124.88 39.13 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.922 179.793 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -81.8 79.4 8.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.08 179.995 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -103.9 6.87 10.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.986 179.862 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -74.24 -60.47 2.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.041 -179.89 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 10.3 t -77.08 -15.03 59.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.833 -179.932 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -80.9 149.22 29.53 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.046 179.911 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -116.83 167.51 11.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.927 -179.838 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -92.99 -67.26 1.09 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.468 -179.982 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.461 HG11 ' HD2' ' A' ' 96' ' ' PRO . 3.2 t -84.88 125.43 70.81 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 120.586 0.231 . . . . 0.0 110.981 179.949 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.461 ' HD2' HG11 ' A' ' 95' ' ' VAL . 36.6 Cg_endo -65.39 -60.18 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.476 2.118 . . . . 0.0 112.268 -179.92 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.461 ' O ' HG12 ' A' ' 95' ' ' VAL . 81.7 p -90.33 154.66 19.53 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.9 -179.852 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.149 -0.929 . . . . 0.0 111.042 179.879 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 2.0 t . . . . . 0 N--CA 1.487 1.392 0 CA-C-O 120.833 0.349 . . . . 0.0 110.969 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.5 p -89.12 142.63 12.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.021 -179.764 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.64 143.64 26.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.911 179.997 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 18.0 t -78.13 -176.09 4.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.717 179.73 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -103.9 -55.91 2.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.896 -179.742 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.43 HD11 ' HG2' ' A' ' 68' ' ' LYS . 0.4 OUTLIER -62.7 -80.89 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.622 179.532 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . 0.705 ' HB2' HD23 ' A' ' 47' ' ' LEU . 1.0 OUTLIER -87.02 117.43 68.62 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.831 179.193 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -73.77 6.37 2.89 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.314 2.01 . . . . 0.0 111.957 179.619 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 9' ' ' ASN . . . . . 0.494 ' HB3' ' OE1' ' A' ' 49' ' ' GLU . 71.5 m-20 -123.08 38.73 4.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.83 179.92 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . 0.555 ' HB2' ' HB3' ' A' ' 46' ' ' MET . . . -59.37 88.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.961 -179.189 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.477 ' HG3' ' CD ' ' A' ' 49' ' ' GLU . 12.8 mttp -112.73 123.36 50.12 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 177.553 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -47.19 171.11 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -176.668 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 13' ' ' PHE . . . . . 0.727 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.2 OUTLIER -86.99 93.57 9.39 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.714 179.529 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . 0.766 ' H ' ' HD2' ' B' ' 15' ' ' PRO . 17.1 t -124.3 -54.66 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.366 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -176.955 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 15' ' ' PRO . . . . . 0.766 ' HD2' ' H ' ' B' ' 14' ' ' VAL . 9.3 Cg_endo -51.68 -34.33 53.05 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 122.415 2.077 . . . . 0.0 112.597 -178.609 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . 0.481 ' O ' ' HB2' ' A' ' 21' ' ' LYS . . . 78.46 -18.55 5.48 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.314 -179.446 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.543 HG21 ' HB2' ' B' ' 15' ' ' PRO . 20.9 m -96.99 -171.12 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.514 0.197 . . . . 0.0 110.629 179.417 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.531 ' HG2' HE22 ' A' ' 20' ' ' GLN . 33.2 mttt -59.67 96.55 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.9 0.381 . . . . 0.0 110.571 -179.806 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.44 ' CE1' ' HG3' ' B' ' 15' ' ' PRO . 0.1 OUTLIER -85.31 98.09 10.33 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.047 -179.166 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 79.62 100.68 0.27 Allowed Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.436 -179.928 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 22.9 t30 -88.96 -16.95 30.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.767 0.318 . . . . 0.0 110.972 179.981 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.248 0.995 0 CA-C-O 118.262 -0.875 . . . . 0.0 111.05 179.985 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.201 0 CA-C-O 120.079 -0.289 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -76.24 152.38 96.19 Favored 'Cis proline' 0 C--N 1.348 0.525 0 C-N-CA 123.462 -1.474 . . . . 0.0 112.361 0.183 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.72 10.63 10.82 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.905 179.945 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -79.19 -15.29 80.57 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.571 179.966 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.642 ' HB2' ' HD3' ' A' ' 6' ' ' PRO . 23.5 m -95.24 -51.45 0.24 Allowed Pre-proline 0 CA--C 1.533 0.301 0 N-CA-C 111.469 0.174 . . . . 0.0 111.469 -179.757 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.642 ' HD3' ' HB2' ' A' ' 5' ' ' SER . 37.9 Cg_exo -60.77 91.76 0.09 OUTLIER 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 122.24 1.96 . . . . 0.0 112.358 -179.737 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.452 ' HB2' HE22 ' A' ' 33' ' ' GLN . 0.7 OUTLIER -100.98 -100.47 0.25 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.069 -179.951 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.797 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 11.7 t -88.09 -30.32 19.96 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.339 -179.776 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.68 -36.4 74.13 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 177.107 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.2 -36.26 71.84 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.785 177.341 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.797 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.4 mtm -64.45 -38.51 91.28 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.383 178.527 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 8' ' ' THR . 50.9 mt -52.45 -49.39 64.71 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.16 179.516 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.41 -32.38 73.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.184 178.233 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.78 27.72 6.23 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.81 -178.502 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.701 ' HB3' ' HB3' ' A' ' 19' ' ' GLU . . . -138.17 115.23 9.24 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.695 -0.229 . . . . 0.0 111.202 179.696 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_exo -55.82 168.03 1.95 Allowed 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.356 2.037 . . . . 0.0 111.589 178.845 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.589 ' O ' ' HG3' ' A' ' 20' ' ' GLN . 52.0 Cg_exo -53.96 -40.74 79.77 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.258 1.972 . . . . 0.0 112.252 -179.728 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -74.21 4.99 4.87 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.76 -179.546 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.701 ' HB3' ' HB3' ' A' ' 15' ' ' ALA . 2.7 tp10 -102.04 14.06 33.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.611 0.243 . . . . 0.0 111.346 -179.208 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.589 ' HG3' ' O ' ' A' ' 17' ' ' PRO . 0.0 OUTLIER -54.41 -56.95 13.45 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.494 -178.86 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.58 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -55.94 -20.38 15.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.642 -177.963 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.426 HE21 ' HG3' ' A' ' 23' ' ' MET . 4.9 tt0 -73.0 -79.04 0.08 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.956 0.408 . . . . 0.0 111.453 179.533 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.633 ' HA ' ' HE1' ' A' ' 11' ' ' MET . 0.0 OUTLIER -69.93 -94.32 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -176.684 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.586 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -61.46 3.34 0.13 Allowed 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 -174.705 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.74 -117.78 11.18 Favored Glycine 0 N--CA 1.444 -0.778 0 N-CA-C 108.214 -1.954 . . . . 0.0 108.214 -174.475 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.448 ' HG2' ' O ' ' A' ' 51' ' ' ASP . 1.3 mp0 -76.07 -67.55 0.67 Allowed 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 168.987 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.569 ' NH1' ' HB2' ' A' ' 30' ' ' PRO . 0.0 OUTLIER -160.5 8.97 0.09 Allowed 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 114.258 -1.337 . . . . 0.0 108.086 176.466 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.609 HD23 ' HA ' ' A' ' 44' ' ' THR . 0.3 OUTLIER -59.66 -73.85 0.08 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.316 -1.311 . . . . 0.0 114.051 -173.889 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.562 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -35.27 -48.45 1.15 Allowed Pre-proline 0 CA--C 1.541 0.596 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -175.42 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.569 ' HB2' ' NH1' ' A' ' 27' ' ' ARG . 45.1 Cg_exo -59.65 -41.96 51.24 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.372 2.048 . . . . 0.0 113.387 -178.601 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.616 HD12 HG23 ' A' ' 69' ' ' VAL . 0.0 OUTLIER -70.33 -47.29 61.73 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 120.478 -0.489 . . . . 0.0 109.87 -178.957 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.822 HG12 HG11 ' A' ' 69' ' ' VAL . 0.3 OUTLIER -73.3 -13.69 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.652 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.096 178.505 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.617 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 4.3 tp60 -61.33 -41.7 97.46 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 177.531 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.25 -28.8 67.53 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.124 175.13 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' MET . . . . . 0.59 ' SD ' HG13 ' A' ' 69' ' ' VAL . 5.5 mtt -102.01 27.42 6.6 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.345 178.393 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.617 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -63.79 -31.59 6.62 Favored Pre-proline 0 CA--C 1.537 0.468 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -177.083 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.584 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 54.9 Cg_exo -34.63 -34.32 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.255 0 C-N-CA 122.25 1.967 . . . . 0.0 112.406 179.33 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 23.5 m -78.6 -88.08 0.06 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.79 176.638 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.438 ' CB ' ' HG ' ' A' ' 76' ' ' LEU . 0.1 OUTLIER -171.34 62.47 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.408 178.14 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.485 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -43.81 -41.14 4.84 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.653 179.586 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.562 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -50.87 -53.61 25.68 Favored Glycine 0 C--N 1.33 0.22 0 CA-C-N 116.02 -0.536 . . . . 0.0 113.807 -178.692 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.491 ' HE2' ' SD ' ' A' ' 46' ' ' MET . 0.4 OUTLIER -77.43 -39.09 48.08 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.826 0.313 . . . . 0.0 111.764 -177.969 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.586 HD12 ' HA ' ' A' ' 73' ' ' VAL . 31.2 mt -53.86 -56.97 6.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.5 0.19 . . . . 0.0 110.972 -179.19 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.609 ' HA ' HD23 ' A' ' 28' ' ' LEU . 10.0 t -50.76 -42.26 57.54 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.811 0.339 . . . . 0.0 110.418 178.808 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.633 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -50.62 -67.93 1.69 Allowed Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 115.953 -0.567 . . . . 0.0 112.981 -179.761 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.685 ' HE2' HG21 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -55.29 -46.37 76.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.789 0.295 . . . . 0.0 111.664 -178.723 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.614 HD12 ' HB2' ' B' ' 7' ' ' ASN . 3.2 mm? -80.18 6.52 11.52 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 111.537 0.199 . . . . 0.0 111.537 -179.166 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.633 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.1 OUTLIER -65.81 -10.74 40.46 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.064 0.459 . . . . 0.0 110.372 179.558 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.492 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.5 mm-40 -79.23 18.43 0.68 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.415 177.831 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.42 ' H ' ' C ' ' A' ' 48' ' ' LEU . 1.3 tt -83.3 160.75 3.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.175 -179.381 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.462 ' HB2' ' HG3' ' A' ' 54' ' ' GLU . 17.7 m-20 -71.15 160.29 33.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.938 -178.837 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.422 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 5.8 m120 -87.69 -29.61 20.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.995 177.349 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 67.9 m -72.72 -33.05 66.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.897 178.12 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.462 ' HG3' ' HB2' ' A' ' 51' ' ' ASP . 14.8 mt-10 -75.83 -28.05 58.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.612 179.041 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.499 HD11 ' HB2' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -59.64 -48.81 80.18 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.303 179.597 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.458 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 1.1 tm? -61.43 -37.0 81.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.409 179.322 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.509 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 4.8 m-70 -64.52 -35.98 82.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.259 178.428 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.544 ' HB3' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -66.01 -41.94 90.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.411 178.702 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.543 HD21 ' NE ' ' A' ' 27' ' ' ARG . 3.4 tp -69.69 -14.67 62.92 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.884 179.475 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.509 ' HG2' ' O ' ' A' ' 57' ' ' HIS . 5.0 pt-20 -106.77 -3.26 20.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.818 179.282 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.563 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 4.6 m -124.39 84.74 56.29 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.968 -179.548 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -60.35 -35.03 92.8 Favored 'Trans proline' 0 N--CA 1.464 -0.255 0 C-N-CA 122.214 1.943 . . . . 0.0 112.094 179.517 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.467 ' O ' ' HB2' ' A' ' 67' ' ' SER . 0.0 OUTLIER -78.81 -44.89 22.11 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.768 -179.419 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.542 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 12.8 m -74.22 -50.44 19.11 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.827 0.346 . . . . 0.0 111.539 -177.996 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.571 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -58.16 -64.96 0.73 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.118 -179.027 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.547 ' HA ' ' HE3' ' A' ' 35' ' ' MET . 0.6 OUTLIER -49.19 -33.87 13.38 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.793 0.33 . . . . 0.0 110.793 -178.801 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.583 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.6 OUTLIER -69.58 -37.03 76.8 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 121.057 0.456 . . . . 0.0 110.148 177.933 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.4 ttpt -65.76 -57.86 7.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.081 178.491 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.822 HG11 HG12 ' A' ' 32' ' ' ILE . 46.9 t -63.48 -19.28 23.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.781 178.925 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.618 ' O ' HG23 ' A' ' 73' ' ' VAL . 9.1 t70 -55.89 -49.59 72.99 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 176.708 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.404 ' O ' ' HB2' ' A' ' 74' ' ' ALA . 0.7 OUTLIER -69.02 -25.74 64.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.768 176.731 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.714 ' HB3' ' HA ' ' A' ' 69' ' ' VAL . . . -62.15 -44.25 97.03 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.937 179.758 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.618 HG23 ' O ' ' A' ' 70' ' ' ASP . 2.5 m -61.06 -31.71 50.71 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 177.419 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.404 ' HB2' ' O ' ' A' ' 71' ' ' GLU . . . -66.1 -38.5 88.38 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.039 178.946 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.685 HG21 ' HE2' ' A' ' 46' ' ' MET . 0.9 OUTLIER -58.72 -31.97 45.55 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.095 0 CA-C-O 121.001 0.429 . . . . 0.0 110.124 179.262 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.438 ' HG ' ' CB ' ' A' ' 39' ' ' LEU . 2.4 tm? -70.97 -46.77 61.77 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.943 178.177 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -52.86 -37.05 59.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.405 179.212 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.21 -22.61 38.69 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.844 178.819 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.527 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 20.4 t-80 -65.37 -36.77 84.99 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.714 179.598 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -82.84 0.68 42.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.149 -179.662 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -72.84 -70.88 0.33 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.155 -179.866 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.516 ' HD2' HG11 ' B' ' 1' ' ' VAL . 0.1 OUTLIER -72.5 -17.33 61.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.991 -179.842 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.527 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -86.99 -2.85 58.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.98 -179.981 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -73.87 16.0 0.25 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.729 178.693 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.494 ' H ' ' C ' ' A' ' 83' ' ' GLU . . . -63.3 114.28 3.72 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.955 -179.782 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.28 -167.37 0.41 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.896 -179.786 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.15 -172.67 1.44 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.83 -179.812 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -74.61 81.75 2.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.065 -179.897 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -100.59 15.85 4.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.892 179.883 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -86.7 14.71 6.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.912 -179.948 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.448 ' HB3' ' H ' ' A' ' 92' ' ' ALA . 3.5 m -77.93 -158.43 0.12 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.72 179.828 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.448 ' H ' ' HB3' ' A' ' 91' ' ' SER . . . -83.92 60.56 5.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.988 179.981 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 66.2 p -115.48 173.65 6.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.867 179.928 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -85.02 68.18 3.54 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.473 179.858 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 3.8 p -95.51 128.15 39.22 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 120.647 0.261 . . . . 0.0 110.99 179.977 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -72.35 95.73 0.78 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.457 2.105 . . . . 0.0 112.282 -179.879 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.2 p -91.66 39.21 1.0 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.918 179.999 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.1 t . . . . . 0 C--O 1.249 1.027 0 CA-C-O 117.967 -1.016 . . . . 0.0 111.073 179.98 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . 0.516 HG11 ' HD2' ' A' ' 82' ' ' LYS . 0.3 OUTLIER . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 120.894 0.378 . . . . 0.0 110.94 . . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . 0.473 HG13 ' HB2' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -94.64 91.15 2.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.889 179.87 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.87 81.73 4.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.937 -179.815 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 45.3 t -86.61 160.99 18.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.743 179.869 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -104.28 -46.71 4.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.886 179.894 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 5.7 mt -69.66 -78.59 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.683 179.706 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . 0.614 ' HB2' HD12 ' A' ' 47' ' ' LEU . 1.0 OUTLIER -82.1 127.95 69.82 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.951 179.494 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . 0.474 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 2.9 Cg_exo -76.96 -6.06 16.4 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.525 2.15 . . . . 0.0 111.948 179.249 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 9' ' ' ASN . . . . . 0.515 ' H ' HD21 ' B' ' 7' ' ' ASN . 14.6 m120 -123.12 56.65 1.16 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.945 179.963 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . 0.473 ' HB2' HG13 ' B' ' 2' ' ' VAL . . . -60.26 96.73 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.567 179.955 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.492 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 0.7 OUTLIER -122.21 131.21 53.82 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.499 178.785 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -49.31 171.83 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.068 0.461 . . . . 0.0 112.087 -178.787 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 13' ' ' PHE . . . . . 0.466 ' CE1' ' HG ' ' A' ' 48' ' ' LEU . 0.3 OUTLIER -87.34 90.18 8.27 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.03 179.498 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . 0.66 HG21 ' HD3' ' B' ' 15' ' ' PRO . 0.5 OUTLIER -130.33 -37.51 0.03 OUTLIER Pre-proline 0 C--N 1.323 -0.583 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 -176.669 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' B' B ' 15' ' ' PRO . . . . . 0.66 ' HD3' HG21 ' B' ' 14' ' ' VAL . 83.6 Cg_exo -46.8 -38.19 22.53 Favored 'Trans proline' 0 C--N 1.357 1.023 0 C-N-CA 121.818 1.679 . . . . 0.0 112.711 -179.004 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . 0.459 ' O ' ' HD2' ' A' ' 21' ' ' LYS . . . 80.64 -25.23 3.44 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.498 -179.906 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -98.32 -176.65 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.611 0.243 . . . . 0.0 110.846 179.636 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.58 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -60.52 90.63 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.944 0.402 . . . . 0.0 110.815 -179.888 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.469 ' CG ' ' HG2' ' B' ' 15' ' ' PRO . 0.5 OUTLIER -84.05 120.3 25.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.893 -179.743 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 87.73 38.33 7.58 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.364 -179.56 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 21.8 p30 -84.63 175.2 9.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.766 0.317 . . . . 0.0 110.885 -179.918 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.195 -0.907 . . . . 0.0 111.065 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.829 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 9.0 t . . . . . 0 N--CA 1.455 -0.192 0 CA-C-O 120.668 0.271 . . . . 0.0 110.355 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.42 -37.77 78.93 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 176.439 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 42.5 t -69.44 -35.08 75.33 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.683 177.053 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.829 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.2 mtm -64.41 -38.61 91.65 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.117 178.223 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.754 HD21 ' HB3' ' A' ' 24' ' ' LEU . 46.1 mt -52.42 -49.31 64.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.211 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.55 -30.53 70.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.146 178.057 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.5 p -101.44 17.92 21.46 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.763 -178.473 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.613 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.067 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.613 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.4 OUTLIER . . . . . 0 N--CA 1.457 -0.093 0 CA-C-O 120.741 0.305 . . . . 0.0 111.023 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.52 -63.56 1.1 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.13 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.617 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -55.97 -19.55 12.87 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.643 -178.239 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.551 ' N ' ' HE2' ' A' ' 21' ' ' LYS . 24.1 tt0 -73.61 -80.48 0.07 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.085 0.469 . . . . 0.0 111.465 179.039 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' MET . . . . . 0.681 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.8 -95.24 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.816 -176.807 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.853 HD12 ' HD3' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -60.47 -1.37 0.35 Allowed 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -175.522 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.589 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.76 -116.04 8.52 Favored Glycine 0 N--CA 1.446 -0.68 0 N-CA-C 108.423 -1.871 . . . . 0.0 108.423 -174.653 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.97 -69.4 0.5 Allowed 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 168.765 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.853 ' HD3' HD12 ' A' ' 24' ' ' LEU . 0.5 OUTLIER -160.06 9.99 0.11 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.226 -1.352 . . . . 0.0 108.002 175.007 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.998 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.41 -74.88 0.06 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.146 -1.388 . . . . 0.0 114.012 -173.456 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.6 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -34.54 -49.2 0.97 Allowed Pre-proline 0 CA--C 1.537 0.465 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -175.754 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.599 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 52.1 Cg_exo -57.68 -44.68 39.14 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.297 1.998 . . . . 0.0 113.424 -179.025 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.595 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.75 -44.07 67.54 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.178 -178.371 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.832 HD11 HD23 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -76.19 -12.72 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.13 178.021 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.633 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 3.2 tp60 -62.58 -37.41 86.09 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 176.37 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.78 -32.39 72.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.25 -0.887 . . . . 0.0 108.934 174.601 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' MET . . . . . 0.512 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 7.3 mtt -100.34 27.96 5.33 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.221 177.842 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.633 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 2.1 p-80 -63.77 -32.61 8.2 Favored Pre-proline 0 CA--C 1.536 0.442 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -177.328 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.544 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 62.0 Cg_exo -38.24 -28.57 0.12 Allowed 'Trans proline' 0 C--N 1.362 1.244 0 C-N-CA 122.224 1.949 . . . . 0.0 112.229 179.412 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.732 HG21 HG13 ' A' ' 73' ' ' VAL . 7.1 m -78.08 -86.54 0.06 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.874 176.705 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.497 ' O ' HG13 ' A' ' 43' ' ' ILE . 2.6 tp -171.46 49.7 0.02 OUTLIER 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.065 178.409 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.439 ' CA ' HG13 ' A' ' 43' ' ' ILE . . . -32.5 -46.5 0.14 Allowed 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 112.262 0.468 . . . . 0.0 112.262 -178.846 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.6 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -44.72 -59.12 4.45 Favored Glycine 0 C--N 1.33 0.216 0 CA-C-N 116.132 -0.485 . . . . 0.0 114.127 -178.953 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.739 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.5 OUTLIER -76.66 -27.08 55.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 117.032 0.416 . . . . 0.0 111.798 -177.646 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.775 HD12 HG21 ' A' ' 32' ' ' ILE . 0.9 OUTLIER -57.83 -56.34 16.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.735 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.998 ' HA ' HD22 ' A' ' 28' ' ' LEU . 12.3 t -50.54 -40.55 52.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.47 179.239 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.657 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -50.5 -68.41 1.46 Allowed Glycine 0 N--CA 1.451 -0.304 0 CA-C-N 115.913 -0.585 . . . . 0.0 113.28 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.655 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.61 -49.34 73.05 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 122.809 -0.23 . . . . 0.0 111.493 -178.365 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.535 HD12 ' HB2' ' B' ' 7' ' ' ASN . 2.3 mm? -79.94 9.62 5.17 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -178.366 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.627 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.96 -22.01 66.45 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.946 0.403 . . . . 0.0 110.606 179.276 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.565 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 3.4 mm-40 -74.63 21.72 0.11 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.062 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.47 ' H ' ' C ' ' A' ' 48' ' ' LEU . 2.6 tt -83.24 165.1 2.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.795 179.584 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.489 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 20.4 m-20 -70.79 156.38 39.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.862 0.363 . . . . 0.0 111.573 -179.109 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.864 ' HA ' HD23 ' A' ' 55' ' ' LEU . 15.6 m-80 -88.9 -28.24 20.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.778 177.391 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.4 t -74.03 -30.18 62.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.664 177.396 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.489 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 4.9 mm-40 -80.11 -26.9 39.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.592 178.765 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.864 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.8 OUTLIER -59.16 -46.61 87.93 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.872 0.368 . . . . 0.0 110.052 179.636 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.438 HD22 ' HA ' ' A' ' 56' ' ' LEU . 0.2 OUTLIER -64.4 -41.31 96.72 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.468 179.19 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.523 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 7.0 t60 -64.5 -30.39 71.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.267 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.477 ' HB3' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -65.89 -45.24 82.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.869 -179.667 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.631 HD23 ' CG ' ' A' ' 27' ' ' ARG . 0.1 OUTLIER -66.38 -18.49 65.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.787 179.398 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.523 ' HG2' ' O ' ' A' ' 57' ' ' HIS . 4.1 pt-20 -100.14 -8.05 24.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.234 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.646 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.9 OUTLIER -125.38 88.1 54.68 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.946 179.737 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -60.06 -33.07 95.55 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.278 1.985 . . . . 0.0 112.23 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -78.0 -49.34 14.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.59 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 68.3 m -69.69 -32.24 70.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.888 0.375 . . . . 0.0 111.336 -178.663 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.646 ' HB3' ' O ' ' A' ' 61' ' ' SER . 1.1 tp -73.34 -65.23 0.84 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.598 -178.512 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.599 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -49.02 -29.67 5.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.186 -177.839 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.547 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.2 OUTLIER -65.43 -43.79 89.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.101 0.477 . . . . 0.0 110.286 178.292 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.452 ' HE3' HD11 ' A' ' 50' ' ' ILE . 22.1 mtpt -65.86 -55.86 14.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.626 179.208 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.507 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 53.2 t -65.01 -19.74 26.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.662 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.547 ' HB3' ' O ' ' A' ' 67' ' ' SER . 7.2 t70 -55.83 -48.52 75.3 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 176.574 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.48 ' O ' HG13 ' A' ' 75' ' ' VAL . 13.7 tt0 -67.06 -33.97 76.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.637 176.745 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.684 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -55.55 -44.73 77.06 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.651 178.647 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.732 HG13 HG21 ' A' ' 38' ' ' THR . 11.7 t -60.0 -32.49 50.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.936 177.818 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.43 -36.38 65.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.629 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.605 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.15 -28.84 35.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 120.922 0.391 . . . . 0.0 110.268 179.968 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.739 HD11 ' HB3' ' A' ' 42' ' ' LYS . 3.4 mm? -71.91 -54.32 10.39 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.802 178.566 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 25.5 mm100 -51.3 -36.63 43.35 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.469 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.48 -26.14 35.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.873 178.351 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 60.6 t60 . . . . . 0 C--N 1.331 -0.223 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.21 -179.423 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.756 0.312 . . . . 0.0 110.944 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.51 ' HB3' HD11 ' A' ' 47' ' ' LEU . 17.6 tp -68.94 -76.53 0.09 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.777 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 7' ' ' ASN . . . . . 0.535 ' HB2' HD12 ' A' ' 47' ' ' LEU . 1.7 t-20 -88.55 135.96 31.89 Favored Pre-proline 0 C--N 1.331 -0.197 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.856 179.38 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 8' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 5.7 Cg_exo -79.68 -3.65 13.01 Favored 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 122.73 2.287 . . . . 0.0 111.974 179.245 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 9' ' ' ASN . . . . . 0.481 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 9.6 m-20 -123.16 51.09 1.48 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.174 -179.691 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 10' ' ' ALA . . . . . 0.655 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.23 93.69 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.746 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.565 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 3.0 mttp -124.94 154.08 41.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.376 178.521 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -54.51 166.12 0.48 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.808 0.337 . . . . 0.0 111.316 -179.341 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 13' ' ' PHE . . . . . 0.657 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.1 t80 . . . . . 0 C--N 1.331 -0.216 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.761 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 18' ' ' LYS . . . . . 0.617 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.846 0.355 . . . . 0.0 110.79 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 1.3 t80 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.957 -179.812 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.851 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 9.7 t . . . . . 0 N--CA 1.455 -0.177 0 CA-C-O 120.581 0.229 . . . . 0.0 110.404 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.99 -34.49 71.9 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 177.046 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.82 -35.72 70.01 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.608 177.151 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.851 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 3.6 mtm -64.6 -38.09 89.83 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.189 177.938 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.654 HD21 ' HB3' ' A' ' 24' ' ' LEU . 68.8 mt -52.69 -50.78 62.64 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.003 179.463 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.5 -26.6 67.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.715 177.512 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.43 18.12 20.94 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.645 -178.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.814 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 CA--C 1.532 0.283 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.994 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.814 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.9 OUTLIER . . . . . 0 N--CA 1.455 -0.202 0 CA-C-O 120.59 0.233 . . . . 0.0 111.029 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.442 ' CD ' ' H ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -46.86 -61.37 1.89 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.286 -178.96 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.574 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -56.11 -25.11 44.57 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.685 -178.282 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.762 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 0.7 OUTLIER -73.26 -77.04 0.11 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.834 0.35 . . . . 0.0 111.627 179.921 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 23' ' ' MET . . . . . 0.639 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -68.99 -95.91 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -176.483 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.654 ' HB3' HD21 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -61.9 -1.8 0.73 Allowed 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -175.515 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.533 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.8 -116.64 9.21 Favored Glycine 0 N--CA 1.446 -0.688 0 N-CA-C 108.535 -1.826 . . . . 0.0 108.535 -174.798 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.499 ' O ' HD13 ' A' ' 55' ' ' LEU . 0.9 OUTLIER -76.13 -69.97 0.47 Allowed 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 169.052 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.772 ' HG3' HD21 ' A' ' 31' ' ' LEU . 7.4 tpt180 -159.96 13.52 0.13 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.4 -1.273 . . . . 0.0 108.044 175.566 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.495 HD12 HD11 ' A' ' 32' ' ' ILE . 4.1 mm? -57.3 -78.85 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.406 -1.27 . . . . 0.0 113.574 -173.439 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.835 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -36.05 -49.58 1.61 Allowed Pre-proline 0 CA--C 1.537 0.469 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -175.676 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.58 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 55.0 Cg_exo -55.29 -43.05 62.45 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.25 1.966 . . . . 0.0 113.611 -178.407 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.869 HD22 ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -71.18 -48.44 51.67 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.065 0.459 . . . . 0.0 110.336 -178.493 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.495 HD11 HD12 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -71.87 -14.26 17.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.091 178.672 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.631 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.3 OUTLIER -62.24 -40.77 97.29 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 176.893 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.38 -30.51 71.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.166 174.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' MET . . . . . 0.534 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 5.7 mtt -103.15 27.2 7.4 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.394 178.48 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.631 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 2.4 p-80 -62.92 -32.55 9.05 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -177.486 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.579 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 57.2 Cg_exo -36.0 -32.94 0.11 Allowed 'Trans proline' 0 C--N 1.362 1.266 0 C-N-CA 122.221 1.948 . . . . 0.0 112.199 179.014 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 62.6 m -78.18 -88.38 0.05 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.83 176.507 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.503 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.1 OUTLIER -171.31 61.06 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.513 178.324 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.481 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -47.02 -31.99 3.65 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.838 0.351 . . . . 0.0 111.508 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.643 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -43.24 -68.38 0.81 Allowed Glycine 0 CA--C 1.519 0.315 0 CA-C-N 115.697 -0.683 . . . . 0.0 114.597 -178.178 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.73 ' NZ ' ' HA ' ' B' ' 12' ' ' GLU . 0.7 OUTLIER -77.58 -29.16 51.92 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -176.809 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.649 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 37.6 mt -53.75 -52.16 37.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 121.157 -0.217 . . . . 0.0 111.378 -178.656 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.556 HG22 ' O ' ' A' ' 41' ' ' GLY . 5.6 t -48.17 -45.73 33.89 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.98 0.419 . . . . 0.0 110.293 178.752 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.714 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -52.07 -60.48 7.56 Favored Glycine 0 N--CA 1.453 -0.232 0 CA-C-N 115.623 -0.717 . . . . 0.0 113.76 -179.512 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.628 ' SD ' ' HE3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.74 -52.85 62.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.703 0.252 . . . . 0.0 111.52 -178.215 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.528 HD12 ' HB2' ' B' ' 7' ' ' ASN . 1.7 mm? -80.32 7.94 8.52 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -178.893 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.494 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.08 -15.15 62.83 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.922 0.391 . . . . 0.0 110.573 179.423 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -79.59 20.49 0.57 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.842 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.467 HG22 ' HG2' ' A' ' 26' ' ' GLU . 0.2 OUTLIER -83.43 161.43 3.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.745 -179.942 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.449 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 3.5 m-20 -68.27 157.06 36.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.821 -178.419 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.916 ' HA ' HD23 ' A' ' 55' ' ' LEU . 20.7 m-80 -82.4 -31.42 29.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.149 178.037 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.477 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 1.0 OUTLIER -74.08 -30.86 62.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.348 0.594 . . . . 0.0 109.783 177.613 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.583 ' O ' ' HG2' ' A' ' 58' ' ' MET . 0.0 OUTLIER -78.77 -26.11 44.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.431 178.904 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.916 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -61.42 -49.51 76.58 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.674 -179.885 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.578 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 1.2 pp -62.81 -39.02 92.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.956 0.407 . . . . 0.0 110.69 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.646 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 13.2 t60 -62.37 -20.38 64.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.959 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.614 ' HB3' ' HG ' ' A' ' 65' ' ' LEU . 24.9 mmt -76.62 -51.58 11.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.115 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 56' ' ' LEU . 3.9 pp -64.48 -10.5 25.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.911 0.386 . . . . 0.0 110.429 179.22 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.646 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 0.0 OUTLIER -106.66 -8.22 17.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.747 179.501 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.603 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 3.3 m -122.82 79.93 49.39 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.203 -179.519 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -56.11 -32.75 87.94 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.161 1.907 . . . . 0.0 111.671 178.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -78.53 -51.54 9.81 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.891 -179.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.603 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 20.0 m -69.18 -52.07 31.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.951 0.405 . . . . 0.0 111.554 -177.778 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.869 ' HG ' HD22 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -57.81 -59.44 5.22 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.373 -178.535 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.672 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.7 OUTLIER -50.02 -33.18 17.26 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.116 -177.949 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.597 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 6.5 t -68.23 -39.1 82.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.2 0.524 . . . . 0.0 110.255 178.231 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.534 ' HE2' ' SD ' ' A' ' 58' ' ' MET . 1.6 ttpt -65.91 -59.12 4.16 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.434 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.497 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 42.1 t -62.57 -19.28 22.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.516 178.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.656 ' O ' HG22 ' A' ' 73' ' ' VAL . 18.5 t70 -54.88 -48.81 72.52 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 176.42 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.477 ' HB3' HD13 ' B' ' 6' ' ' LEU . 20.4 tt0 -68.88 -26.85 65.33 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.503 -0.772 . . . . 0.0 109.844 176.632 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.649 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -63.68 -47.09 82.61 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.185 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.656 HG22 ' O ' ' A' ' 70' ' ' ASP . 3.4 m -60.08 -28.87 42.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 177.789 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.455 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -70.39 -40.13 74.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.066 178.839 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.601 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -55.61 -35.45 38.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 CA-C-O 121.102 0.477 . . . . 0.0 109.811 178.862 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.436 HD13 ' C ' ' A' ' 76' ' ' LEU . 2.9 tm? -69.28 -47.28 65.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.754 177.673 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 20.1 mm-40 -52.07 -36.54 50.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.21 178.44 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.29 -27.46 35.06 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.63 178.395 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 79.1 t60 . . . . . 0 C--N 1.332 -0.191 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.496 179.347 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.768 0.318 . . . . 0.0 110.98 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.515 HD11 ' HG3' ' A' ' 68' ' ' LYS . 5.3 tp -68.66 -74.78 0.12 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.865 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 7' ' ' ASN . . . . . 0.528 ' HB2' HD12 ' A' ' 47' ' ' LEU . 1.3 t-20 -92.68 134.62 27.47 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.7 179.244 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -80.18 -4.17 13.04 Favored 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 122.297 1.998 . . . . 0.0 112.389 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 9' ' ' ASN . . . . . 0.506 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 18.0 m120 -123.28 50.9 1.51 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.852 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 10' ' ' ALA . . . . . 0.437 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.96 96.06 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.219 -0.446 . . . . 0.0 112.068 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.0 OUTLIER -119.07 164.71 15.11 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.685 0.279 . . . . 0.0 110.477 177.445 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 12' ' ' GLU . . . . . 0.73 ' HA ' ' NZ ' ' A' ' 42' ' ' LYS . 0.7 OUTLIER -62.67 161.86 11.6 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.284 -179.352 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 13' ' ' PHE . . . . . 0.714 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.1 t80 . . . . . 0 C--N 1.332 -0.193 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.71 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 18' ' ' LYS . . . . . 0.574 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.83 0.348 . . . . 0.0 110.622 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.777 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.757 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 15.3 t . . . . . 0 CA--C 1.521 -0.154 0 CA-C-O 120.641 0.257 . . . . 0.0 110.626 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.82 -33.49 70.46 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.228 0.537 . . . . 0.0 109.628 177.448 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 14.3 t -74.1 -35.93 64.22 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.874 177.431 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.757 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.6 mtm -64.37 -36.48 84.26 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.038 177.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.692 HD13 HH12 ' A' ' 27' ' ' ARG . 50.5 mt -53.02 -53.83 44.25 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.93 178.864 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.29 -25.14 66.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.667 177.357 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.9 t -101.56 24.65 9.43 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.706 -178.705 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.939 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 CA--C 1.533 0.302 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.915 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.939 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 1.6 tp10 . . . . . 0 N--CA 1.456 -0.154 0 CA-C-O 120.584 0.231 . . . . 0.0 110.985 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.518 ' O ' HD12 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -47.33 -55.08 9.48 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.482 -178.725 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.645 ' HD3' ' H ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.79 -26.4 45.89 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.779 -178.444 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.715 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 0.6 OUTLIER -72.47 -76.75 0.11 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.765 0.317 . . . . 0.0 111.643 -179.44 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 23' ' ' MET . . . . . 0.556 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.16 -96.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -176.841 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.556 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -62.07 -1.95 0.81 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 113.596 0.962 . . . . 0.0 113.596 -175.219 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.43 ' HA3' HD11 ' A' ' 48' ' ' LEU . . . 65.05 -115.75 8.12 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 108.497 -1.841 . . . . 0.0 108.497 -174.062 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.454 ' O ' HD13 ' A' ' 24' ' ' LEU . 0.5 OUTLIER -75.98 -69.9 0.47 Allowed 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 168.995 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.757 ' HG3' HD21 ' A' ' 31' ' ' LEU . 9.5 tpt180 -159.7 13.22 0.14 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 114.282 -1.326 . . . . 0.0 108.029 175.256 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.634 HD12 HD11 ' A' ' 32' ' ' ILE . 3.9 mm? -57.32 -76.46 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.513 -1.221 . . . . 0.0 113.506 -174.218 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.639 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -37.25 -49.87 2.36 Favored Pre-proline 0 CA--C 1.535 0.381 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -175.122 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.556 ' HG2' ' HD2' ' A' ' 27' ' ' ARG . 50.0 Cg_exo -56.71 -43.64 52.86 Favored 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 122.249 1.966 . . . . 0.0 113.64 -177.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.781 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.66 -47.39 60.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.141 0.496 . . . . 0.0 110.185 -178.432 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.753 HG21 HD12 ' A' ' 43' ' ' ILE . 0.5 OUTLIER -75.36 -13.16 15.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.499 178.845 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.658 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 55.0 tp60 -62.59 -39.55 94.07 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 177.025 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.55 -31.93 72.95 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.266 -0.879 . . . . 0.0 108.814 174.711 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' MET . . . . . 0.492 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 6.2 mtt -100.73 27.2 6.08 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.409 177.984 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.658 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.9 p-80 -64.06 -33.19 8.92 Favored Pre-proline 0 CA--C 1.535 0.399 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 -177.097 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.546 ' HD3' ' ND1' ' A' ' 36' ' ' HIS . 53.2 Cg_exo -37.11 -30.39 0.11 Allowed 'Trans proline' 0 C--N 1.361 1.187 0 C-N-CA 122.286 1.991 . . . . 0.0 112.36 179.557 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.912 HG21 HG13 ' A' ' 73' ' ' VAL . 90.2 m -78.28 -85.17 0.07 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.238 177.33 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.533 ' O ' HG13 ' A' ' 43' ' ' ILE . 7.9 tp -171.11 51.29 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.21 178.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.456 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -39.83 -38.18 0.64 Allowed 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.852 -179.547 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.639 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.08 -55.72 9.87 Favored Glycine 0 C--N 1.331 0.289 0 CA-C-N 116.096 -0.502 . . . . 0.0 114.012 -179.174 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.899 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -78.27 -34.27 49.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 117.098 0.449 . . . . 0.0 111.817 -178.654 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.753 HD12 HG21 ' A' ' 32' ' ' ILE . 0.9 OUTLIER -54.11 -55.84 12.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.613 0.245 . . . . 0.0 111.238 -179.083 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.559 HG21 ' CD2' ' A' ' 29' ' ' PHE . 5.2 t -47.22 -49.17 23.67 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.477 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.575 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -50.23 -51.44 30.98 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 121.092 -0.575 . . . . 0.0 112.901 179.149 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.516 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 3.1 mmm -55.72 -68.05 0.23 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.332 0.587 . . . . 0.0 111.364 -179.404 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.74 HD11 ' HB2' ' B' ' 6' ' ' LEU . 4.0 mm? -74.15 10.62 1.16 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.184 -0.917 . . . . 0.0 111.701 -177.425 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.522 ' HB3' ' HD2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -66.17 -24.39 66.64 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.972 0.415 . . . . 0.0 110.302 178.835 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.479 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 3.0 mt-10 -74.59 22.38 0.1 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.967 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.628 HD11 ' HE3' ' A' ' 68' ' ' LYS . 2.6 tt -83.63 166.87 2.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.76 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.447 ' HB2' ' HG3' ' A' ' 54' ' ' GLU . 7.6 m-20 -70.82 155.29 40.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.419 -179.422 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.882 ' HA ' HD23 ' A' ' 55' ' ' LEU . 15.3 m-80 -83.21 -29.62 28.38 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.064 178.062 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.06 -31.88 63.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.747 177.547 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.447 ' HG3' ' HB2' ' A' ' 51' ' ' ASP . 6.1 mt-10 -79.46 -27.17 41.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.699 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.882 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -59.47 -46.73 87.97 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.084 0.469 . . . . 0.0 109.925 179.123 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.496 ' O ' ' HG3' ' A' ' 60' ' ' GLU . 1.0 OUTLIER -61.2 -44.93 96.49 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.653 179.403 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 25.7 t60 -57.08 -40.33 76.7 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.055 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.527 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -58.91 -42.39 89.51 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.645 179.184 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.653 HD12 ' NE ' ' A' ' 27' ' ' ARG . 9.0 tt -63.8 -24.53 67.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.063 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.496 ' HG3' ' O ' ' A' ' 56' ' ' LEU . 17.4 mt-10 -105.3 2.89 29.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.338 -178.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.565 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 43.6 m -122.66 78.24 47.66 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.675 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.458 ' O ' ' HB2' ' A' ' 66' ' ' ARG . 18.7 Cg_endo -57.84 -34.94 98.94 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.339 2.026 . . . . 0.0 112.099 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -78.39 -46.96 18.63 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.728 -179.617 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.524 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 12.8 m -72.91 -53.39 11.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.648 -177.734 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.781 HD21 HD13 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -57.82 -58.9 6.34 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.264 -178.387 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.686 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -50.94 -36.24 37.61 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.859 -0.337 . . . . 0.0 111.102 -178.246 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.4 m -69.39 -36.25 76.58 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.071 0.462 . . . . 0.0 110.292 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.628 ' HE3' HD11 ' A' ' 50' ' ' ILE . 5.5 ttpt -65.77 -56.26 12.89 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.263 178.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.52 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 30.2 t -64.85 -21.23 28.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.36 178.537 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.428 ' HB2' ' O ' ' A' ' 66' ' ' ARG . 13.7 t70 -53.45 -48.03 69.18 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 177.295 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.419 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 0.4 OUTLIER -68.83 -32.92 72.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.767 176.836 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.646 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -55.69 -42.44 75.2 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.163 177.695 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.912 HG13 HG21 ' A' ' 38' ' ' THR . 24.4 t -60.82 -31.65 50.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 176.647 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.419 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -73.46 -36.41 65.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.604 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.569 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -57.73 -28.22 31.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.895 0.379 . . . . 0.0 110.092 179.79 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.899 HD11 ' HB3' ' A' ' 42' ' ' LYS . 3.0 mm? -71.62 -54.31 10.83 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.534 178.358 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -51.12 -34.63 31.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.439 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.5 -30.91 33.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.828 178.479 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 12.5 t-160 . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.083 -179.762 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.641 0.258 . . . . 0.0 111.078 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.74 ' HB2' HD11 ' A' ' 47' ' ' LEU . 16.6 mt -64.85 -87.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.774 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 7' ' ' ASN . . . . . 0.631 ' HB2' HD13 ' A' ' 47' ' ' LEU . 1.4 t-20 -74.46 124.97 90.19 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.708 179.212 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -79.07 3.82 7.08 Favored 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.18 1.92 . . . . 0.0 112.111 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 9' ' ' ASN . . . . . 0.507 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 16.8 m120 -123.53 44.5 2.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.902 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 10' ' ' ALA . . . . . 0.516 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.57 98.13 0.06 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.494 179.552 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.507 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.1 OUTLIER -122.24 -179.51 4.2 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.634 178.848 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -68.46 172.29 6.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.82 179.055 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 13' ' ' PHE . . . . . 0.575 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.1 t80 . . . . . 0 C--N 1.331 -0.204 0 CA-C-O 120.974 0.416 . . . . 0.0 110.93 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 18' ' ' LYS . . . . . 0.613 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 9.1 mttt . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.907 0.384 . . . . 0.0 110.788 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.522 ' HD2' ' HB3' ' A' ' 48' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.902 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.792 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 3.6 t . . . . . 0 N--CA 1.456 -0.171 0 CA-C-O 120.695 0.283 . . . . 0.0 110.273 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.37 -35.43 73.9 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 176.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.7 t -71.08 -36.19 72.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.623 177.116 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.792 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.3 mtm -64.23 -34.4 78.01 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.896 177.807 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.686 HD12 ' SD ' ' A' ' 23' ' ' MET . 1.2 mp -52.74 -52.61 55.68 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.843 178.351 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.02 -26.99 67.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.915 178.312 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.7 p -101.5 21.23 14.61 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.74 -178.795 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.902 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 CA--C 1.534 0.358 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.208 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.902 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 1.7 tp10 . . . . . 0 N--CA 1.456 -0.148 0 CA-C-O 120.88 0.371 . . . . 0.0 110.373 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.53 -68.29 0.18 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.628 -179.082 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.561 ' HE2' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.4 -18.49 6.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.371 -178.066 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.648 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 5.4 tp60 -73.6 -79.82 0.08 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.901 0.381 . . . . 0.0 111.336 178.878 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' MET . . . . . 0.686 ' SD ' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.57 -96.09 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 N-CA-C 112.616 0.599 . . . . 0.0 112.616 -177.08 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.628 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -61.04 0.43 0.23 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.059 0.762 . . . . 0.0 113.059 -176.064 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.584 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.4 -118.12 12.1 Favored Glycine 0 N--CA 1.446 -0.655 0 N-CA-C 108.332 -1.907 . . . . 0.0 108.332 -175.011 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.444 ' O ' HD13 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -75.98 -67.65 0.66 Allowed 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 168.71 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.631 ' HB2' HD13 ' A' ' 55' ' ' LEU . 5.2 tpt180 -160.16 12.0 0.12 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.385 -1.28 . . . . 0.0 108.442 175.373 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.621 HD12 HD11 ' A' ' 32' ' ' ILE . 4.2 mm? -57.82 -80.44 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.846 -1.07 . . . . 0.0 113.713 -174.16 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.675 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -33.46 -50.16 0.74 Allowed Pre-proline 0 CA--C 1.537 0.446 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -175.223 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.603 ' HG2' ' O ' ' A' ' 27' ' ' ARG . 12.7 Cg_endo -59.16 -42.15 53.4 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.204 1.936 . . . . 0.0 113.521 -177.785 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.624 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.09 -45.76 63.08 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 120.144 -0.622 . . . . 0.0 110.151 -179.147 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.621 HD11 HD12 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -74.7 -12.36 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.998 178.142 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.642 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 60.3 tp60 -62.13 -39.29 92.08 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 176.521 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.0 -31.66 71.52 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.298 -0.864 . . . . 0.0 109.076 174.672 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' MET . . . . . 0.521 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 7.1 mtt -100.54 28.13 5.31 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.225 178.014 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.642 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.2 OUTLIER -64.09 -31.95 6.88 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 -177.267 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.543 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 63.0 Cg_exo -37.68 -30.51 0.14 Allowed 'Trans proline' 0 C--N 1.361 1.236 0 C-N-CA 122.047 1.831 . . . . 0.0 112.159 179.055 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.906 HG21 HG13 ' A' ' 73' ' ' VAL . 0.2 OUTLIER -78.16 -89.11 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.737 176.578 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.53 ' H ' ' HB ' ' A' ' 38' ' ' THR . 0.1 OUTLIER -171.24 58.4 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.92 177.718 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.49 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -43.47 -35.4 1.61 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.743 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.661 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.16 -57.42 8.02 Favored Glycine 0 C--O 1.229 -0.216 0 CA-C-N 115.961 -0.563 . . . . 0.0 114.098 -178.474 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.537 ' HE3' ' HA ' ' B' ' 12' ' ' GLU . 1.6 tptm -79.03 -39.01 35.11 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 117.085 0.442 . . . . 0.0 112.15 -178.423 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.697 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 17.2 mt -53.09 -48.62 53.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 C-N-CA 121.155 -0.218 . . . . 0.0 111.426 -177.685 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.527 HG21 ' CD2' ' A' ' 29' ' ' PHE . 5.1 t -47.86 -48.04 31.33 Favored 'General case' 0 CA--C 1.521 -0.17 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 178.596 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.565 ' CA ' ' HB2' ' B' ' 13' ' ' PHE . . . -56.67 -53.25 45.17 Favored Glycine 0 N--CA 1.449 -0.458 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.871 179.212 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.921 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.33 -56.43 20.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.794 0.33 . . . . 0.0 110.982 -179.112 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.623 HD22 ' HB2' ' A' ' 46' ' ' MET . 2.9 mm? -80.28 7.76 8.83 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.397 -179.247 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.484 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.46 -20.9 66.55 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.791 0.329 . . . . 0.0 110.748 179.897 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.48 ' HG3' ' O ' ' B' ' 9' ' ' ASN . 3.6 mt-10 -75.71 20.27 0.18 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.888 179.354 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.64 HD11 ' HE3' ' A' ' 68' ' ' LYS . 2.7 tt -83.58 169.07 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.905 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.44 ' HB2' ' HG3' ' A' ' 54' ' ' GLU . 2.6 m-20 -71.03 155.93 40.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.951 0.405 . . . . 0.0 111.427 -179.626 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.809 ' HA ' HD23 ' A' ' 55' ' ' LEU . 12.0 m-80 -88.06 -28.46 21.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.643 177.238 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.96 -30.67 62.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.608 177.125 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.578 ' O ' ' HG2' ' A' ' 58' ' ' MET . 4.0 mt-10 -77.26 -29.41 53.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.49 178.776 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.809 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -58.79 -46.1 88.36 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.209 -179.901 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.428 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 7.6 tp -60.75 -47.38 86.56 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.558 178.744 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -65.72 -20.07 66.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.375 -179.644 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.631 ' SD ' ' HA ' ' A' ' 65' ' ' LEU . 25.3 mmt -69.65 -54.57 13.28 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.054 -179.708 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.54 HD23 ' CG ' ' A' ' 27' ' ' ARG . 0.1 OUTLIER -63.27 -17.87 62.96 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.893 0.377 . . . . 0.0 110.685 179.479 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.478 ' O ' ' HG3' ' A' ' 60' ' ' GLU . 0.0 OUTLIER -94.73 -13.26 25.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.788 -179.856 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.595 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.5 OUTLIER -122.3 87.66 48.44 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.189 -179.872 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -59.31 -32.22 96.41 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.268 1.979 . . . . 0.0 112.129 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -77.78 -49.77 13.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.618 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.421 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 75.5 m -69.16 -46.34 67.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.185 -178.469 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.631 ' HA ' ' SD ' ' A' ' 58' ' ' MET . 1.2 tp -60.17 -64.74 0.84 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.814 -178.583 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.57 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -49.54 -28.83 5.98 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.875 -177.933 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.482 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 9.2 t -62.32 -45.32 93.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.181 177.843 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.64 ' HE3' HD11 ' A' ' 50' ' ' ILE . 14.2 mtmm -66.45 -62.05 1.67 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.921 179.355 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.471 ' HA ' ' HB3' ' A' ' 72' ' ' ALA . 73.2 t -57.75 -20.72 14.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.756 -179.321 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.482 ' HB3' ' O ' ' A' ' 67' ' ' SER . 10.0 t70 -57.26 -49.22 76.74 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 175.688 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.468 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 5.7 tt0 -67.18 -27.76 67.54 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.547 175.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.697 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -66.1 -36.68 83.83 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.586 178.722 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.906 HG13 HG21 ' A' ' 38' ' ' THR . 5.1 t -59.94 -32.85 50.94 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.184 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 176.23 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -73.69 -34.18 64.76 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.824 175.379 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.594 ' HB ' ' O ' ' A' ' 72' ' ' ALA . 15.7 t -55.03 -33.07 28.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.919 178.205 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.634 ' HB2' HG12 ' A' ' 43' ' ' ILE . 3.1 tm? -71.36 -47.08 58.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.173 177.581 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 32.6 mm-40 -63.87 -24.05 67.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.048 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.8 -24.94 38.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.834 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 26.1 t-80 . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.861 179.785 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 56.6 m-20 . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.65 0.262 . . . . 0.0 110.943 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.582 ' HB3' HD11 ' A' ' 47' ' ' LEU . 27.1 tp -71.92 -83.68 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.381 179.318 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 7' ' ' ASN . . . . . 0.422 ' HA ' ' HD3' ' B' ' 8' ' ' PRO . 1.7 t-20 -82.81 129.15 63.08 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.267 178.151 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 8' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 7.1 Cg_exo -73.94 4.25 4.35 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.187 1.924 . . . . 0.0 111.997 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 9' ' ' ASN . . . . . 0.48 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 18.5 m120 -123.63 37.42 4.42 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.308 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 10' ' ' ALA . . . . . 0.921 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.43 87.5 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.087 179.263 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.45 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 1.5 mmtp -116.21 177.86 4.53 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.964 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 12' ' ' GLU . . . . . 0.537 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -68.21 158.76 32.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.72 0.295 . . . . 0.0 111.065 179.76 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 13' ' ' PHE . . . . . 0.565 ' HB2' ' CA ' ' A' ' 45' ' ' GLY . 1.1 t80 . . . . . 0 C--N 1.332 -0.166 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.857 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 18' ' ' LYS . . . . . 0.412 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.782 0.325 . . . . 0.0 110.672 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.331 -0.237 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.943 -179.664 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.815 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 12.7 t . . . . . 0 N--CA 1.455 -0.225 0 CA-C-O 120.742 0.306 . . . . 0.0 110.236 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.61 -41.01 89.41 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 176.266 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 7.5 t -67.44 -33.79 75.88 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.508 176.644 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.815 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.1 mtm -64.25 -37.24 86.79 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.182 177.844 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.842 HD21 ' HB3' ' A' ' 24' ' ' LEU . 22.9 mt -54.28 -45.99 72.62 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.547 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.8 -36.3 82.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.102 178.542 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -101.16 46.55 0.94 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.047 -179.655 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.794 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 CA--C 1.536 0.437 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 -178.076 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.794 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 1.1 tp10 . . . . . 0 N--CA 1.46 0.03 0 CA-C-O 120.64 0.257 . . . . 0.0 110.876 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.797 HE22 ' HE2' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -47.0 -56.7 5.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.605 -178.853 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.621 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -56.07 -22.34 27.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.648 -178.359 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.621 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 5.4 tp60 -73.46 -79.91 0.08 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.915 0.388 . . . . 0.0 111.677 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' MET . . . . . 0.742 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.76 -96.22 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -176.47 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.842 ' HB3' HD21 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -59.26 -2.45 0.29 Allowed 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 113.647 0.98 . . . . 0.0 113.647 -175.359 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.636 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.48 -116.78 9.45 Favored Glycine 0 N--CA 1.448 -0.549 0 N-CA-C 108.374 -1.891 . . . . 0.0 108.374 -174.621 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.446 ' HG2' ' O ' ' A' ' 51' ' ' ASP . 0.8 OUTLIER -76.23 -69.14 0.52 Allowed 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 168.269 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.766 ' NE ' HD13 ' A' ' 59' ' ' LEU . 0.2 OUTLIER -159.82 13.1 0.13 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.163 -1.381 . . . . 0.0 108.178 174.56 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.546 ' O ' HG13 ' A' ' 32' ' ' ILE . 4.1 mm? -57.64 -78.57 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.662 -1.153 . . . . 0.0 113.439 -174.379 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.617 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -37.42 -48.88 2.47 Favored Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 -174.799 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.59 ' HG3' ' HB2' ' A' ' 24' ' ' LEU . 12.6 Cg_endo -58.69 -43.29 45.82 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 122.14 1.893 . . . . 0.0 113.621 -177.576 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.19 -46.69 60.74 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 120.111 -0.636 . . . . 0.0 110.289 -178.719 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.546 HG13 ' O ' ' A' ' 28' ' ' LEU . 0.4 OUTLIER -73.28 -12.47 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 CA-C-N 116.208 -0.451 . . . . 0.0 109.969 178.224 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.608 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 47.7 tp60 -62.14 -40.54 96.3 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 176.788 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.62 -29.98 69.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.08 174.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' MET . . . . . 0.536 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 6.7 mtt -101.65 27.17 6.61 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.394 178.428 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.608 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -63.66 -32.08 7.49 Favored Pre-proline 0 CA--C 1.537 0.445 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -177.594 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.572 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 50.5 Cg_exo -35.97 -32.55 0.1 Allowed 'Trans proline' 0 C--N 1.363 1.342 0 C-N-CA 122.178 1.919 . . . . 0.0 112.034 178.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.837 HG21 HG13 ' A' ' 73' ' ' VAL . 7.2 m -78.14 -88.58 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.512 176.014 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.509 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.3 OUTLIER -171.59 62.73 0.03 OUTLIER 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.196 177.552 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.516 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -46.67 -34.72 5.32 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.662 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.617 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -52.88 -53.94 30.93 Favored Glycine 0 C--N 1.33 0.239 0 C-N-CA 121.17 -0.538 . . . . 0.0 113.81 -178.439 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.501 ' HD2' ' HG2' ' B' ' 12' ' ' GLU . 0.0 OUTLIER -78.11 -39.0 42.7 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.887 0.343 . . . . 0.0 111.797 -178.387 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.692 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 31.8 mt -53.95 -54.14 22.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.038 -179.385 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.583 HG21 ' CD2' ' A' ' 29' ' ' PHE . 6.4 t -50.17 -45.69 53.58 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 120.889 0.376 . . . . 0.0 110.121 178.003 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.565 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -50.83 -67.46 1.92 Allowed Glycine 0 N--CA 1.451 -0.317 0 CA-C-N 115.606 -0.724 . . . . 0.0 113.235 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.462 ' H ' ' HG2' ' A' ' 46' ' ' MET . 0.0 OUTLIER -56.05 -46.06 79.05 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 -178.031 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.44 HD22 ' N ' ' A' ' 47' ' ' LEU . 3.3 mm? -80.11 3.09 21.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.719 -0.219 . . . . 0.0 111.588 -178.819 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.565 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.96 -8.24 21.51 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.938 0.399 . . . . 0.0 110.54 179.253 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.449 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 1.4 mm-40 -83.47 18.36 1.87 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.373 178.433 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.405 HG23 ' O ' ' A' ' 51' ' ' ASP . 1.5 tt -83.27 163.85 2.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.96 -179.272 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.446 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 3.4 m-20 -70.81 157.56 37.88 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.564 -179.124 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.83 ' HA ' HD23 ' A' ' 55' ' ' LEU . 4.6 m120 -86.61 -28.83 23.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.969 177.81 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 8.7 m -73.9 -32.09 63.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.644 177.55 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -75.98 -29.5 58.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.554 178.714 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.83 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.5 OUTLIER -59.45 -47.74 84.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.504 -179.766 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.462 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 52.4 tp -61.7 -40.72 96.02 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.712 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -66.02 -30.95 71.58 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.164 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.48 -54.85 22.38 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.897 -179.601 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.766 HD13 ' NE ' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -66.1 -13.08 59.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.115 0.483 . . . . 0.0 110.123 178.76 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.506 ' O ' ' HG3' ' A' ' 60' ' ' GLU . 2.3 tp10 -95.46 -12.92 25.07 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.631 177.537 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.547 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 4.1 m -122.57 79.58 47.21 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.732 179.788 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -54.58 -34.21 81.87 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.398 2.065 . . . . 0.0 112.206 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -77.95 -49.72 13.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.552 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.445 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 3.7 m -71.23 -23.12 61.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.904 0.383 . . . . 0.0 111.4 -178.607 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.549 ' HG ' ' N ' ' A' ' 66' ' ' ARG . 1.7 tp -78.54 -64.87 1.07 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.639 -178.474 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.549 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 1.5 ttm180 -51.43 -29.27 15.41 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.849 -178.104 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.56 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 3.3 t -69.67 -40.84 76.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.301 0.572 . . . . 0.0 110.005 177.712 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.628 ' O ' HD11 ' B' ' 6' ' ' LEU . 21.4 ttpt -65.74 -59.69 3.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.203 178.9 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.506 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 54.1 t -62.47 -19.89 23.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.637 179.222 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.56 ' HB3' ' O ' ' A' ' 67' ' ' SER . 17.1 t70 -54.07 -48.99 70.05 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 176.531 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -66.77 -32.9 74.5 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.658 176.381 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.692 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -58.19 -38.11 76.09 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.525 178.877 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.837 HG13 HG21 ' A' ' 38' ' ' THR . 8.0 t -65.26 -31.4 53.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.61 177.421 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.1 -37.08 69.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.146 179.25 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.66 HG12 ' HB2' ' B' ' 5' ' ' ASN . 0.9 OUTLIER -57.61 -31.71 40.2 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.115 0 CA-C-O 121.168 0.508 . . . . 0.0 109.955 178.989 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.64 HD12 HG22 ' A' ' 38' ' ' THR . 2.8 tm? -71.24 -49.91 38.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.39 179.061 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -54.94 -37.33 66.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.664 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.15 -24.28 37.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.811 179.133 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 0.419 ' HB2' ' O ' ' A' ' 75' ' ' VAL . 6.6 t60 . . . . . 0 C--N 1.33 -0.243 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.816 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 5' ' ' ASN . . . . . 0.66 ' HB2' HG12 ' A' ' 75' ' ' VAL . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.735 0.303 . . . . 0.0 110.881 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.628 HD11 ' O ' ' A' ' 68' ' ' LYS . 5.6 mt -62.81 -85.32 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.808 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 7' ' ' ASN . . . . . 0.448 ' HA ' ' HD3' ' B' ' 8' ' ' PRO . 1.1 t-20 -75.85 130.05 79.63 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.866 179.538 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 8' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 6.6 Cg_exo -73.28 -3.41 13.63 Favored 'Trans proline' 0 N--CA 1.46 -0.475 0 C-N-CA 122.368 2.045 . . . . 0.0 111.625 178.654 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 9' ' ' ASN . . . . . 0.409 ' HB3' ' NZ ' ' B' ' 11' ' ' LYS . 2.5 m-80 -123.48 51.97 1.45 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.636 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.86 95.67 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.756 -179.156 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.449 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 9.6 mttp -121.57 121.69 37.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.027 178.072 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 12' ' ' GLU . . . . . 0.501 ' HG2' ' HD2' ' A' ' 42' ' ' LYS . 6.0 mt-10 -49.68 176.87 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.315 0.579 . . . . 0.0 112.366 -177.823 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 13' ' ' PHE . . . . . 0.552 ' CE1' ' HG ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.519 -0.213 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.248 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 18' ' ' LYS . . . . . 0.797 ' HE2' HE22 ' A' ' 20' ' ' GLN . 9.0 mttt . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.925 0.393 . . . . 0.0 110.625 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.444 ' HB3' ' O ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.0 -179.222 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.721 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 3.0 t . . . . . 0 CA--C 1.521 -0.136 0 CA-C-O 120.513 0.197 . . . . 0.0 110.717 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.453 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.18 -36.1 74.74 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 177.406 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.8 t -70.21 -34.81 73.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.729 177.27 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.721 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 4.1 mtm -64.36 -35.34 80.56 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.823 177.633 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.753 HD11 ' HB3' ' A' ' 24' ' ' LEU . 3.8 mp -52.47 -51.21 60.49 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.994 178.769 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.96 -26.92 67.79 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.778 178.343 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.7 15.85 27.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.688 -178.797 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.883 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 CA--C 1.534 0.335 0 CA-C-O 120.546 0.212 . . . . 0.0 111.272 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.883 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 1.3 tp10 . . . . . 0 N--CA 1.454 -0.27 0 CA-C-O 120.737 0.303 . . . . 0.0 110.782 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -47.72 -62.17 1.58 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.424 -178.423 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.642 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.73 -20.92 16.3 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.895 -177.049 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.642 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 23.5 tt0 -73.81 -80.3 0.08 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.013 0.435 . . . . 0.0 111.683 179.309 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' MET . . . . . 0.736 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -70.16 -96.84 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.04 0.755 . . . . 0.0 113.04 -176.453 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.753 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -57.69 0.83 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -175.422 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.587 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.86 -118.06 11.63 Favored Glycine 0 N--CA 1.446 -0.681 0 N-CA-C 108.349 -1.901 . . . . 0.0 108.349 -174.933 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.508 ' HG3' ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -76.07 -67.31 0.69 Allowed 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 168.713 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.73 ' HD3' HD12 ' A' ' 24' ' ' LEU . 0.3 OUTLIER -160.09 8.12 0.1 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.262 -1.335 . . . . 0.0 108.142 175.278 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 1.028 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.3 OUTLIER -59.28 -78.21 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.305 -1.316 . . . . 0.0 113.942 -173.656 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.637 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -33.67 -48.88 0.75 Allowed Pre-proline 0 CA--C 1.535 0.397 0 N-CA-C 113.758 1.022 . . . . 0.0 113.758 -175.147 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.613 ' HG3' ' HB2' ' A' ' 24' ' ' LEU . 18.9 Cg_endo -61.01 -42.86 33.63 Favored 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 122.137 1.891 . . . . 0.0 113.291 -178.052 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.72 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.36 -44.9 64.13 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 119.956 -0.698 . . . . 0.0 110.153 -179.566 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.725 HD11 HD23 ' A' ' 28' ' ' LEU . 0.5 OUTLIER -73.05 -14.46 16.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 CA-C-N 116.233 -0.44 . . . . 0.0 109.891 178.018 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.642 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 4.4 tp-100 -62.41 -38.69 90.64 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 176.489 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.42 -30.12 69.79 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.327 -0.851 . . . . 0.0 108.939 174.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' MET . . . . . 0.596 ' HE2' ' HE ' ' A' ' 66' ' ' ARG . 6.8 mtt -102.18 26.28 7.87 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.209 177.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.642 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.9 p-80 -64.59 -32.08 6.57 Favored Pre-proline 0 CA--C 1.536 0.41 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 -177.102 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.586 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 44.4 Cg_exo -35.1 -34.06 0.1 OUTLIER 'Trans proline' 0 C--N 1.363 1.317 0 C-N-CA 122.24 1.96 . . . . 0.0 112.319 178.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.61 HG22 HD12 ' A' ' 76' ' ' LEU . 52.6 m -78.52 -87.61 0.06 Allowed 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.678 176.358 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.55 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 0.1 OUTLIER -171.47 63.78 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.49 178.102 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.511 ' HA ' HD12 ' A' ' 43' ' ' ILE . . . -47.96 -34.69 9.56 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 120.873 0.368 . . . . 0.0 111.622 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.637 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -51.5 -56.93 13.16 Favored Glycine 0 CA--C 1.518 0.23 0 CA-C-N 115.948 -0.569 . . . . 0.0 114.034 -178.379 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.6 ' HE2' ' SD ' ' A' ' 46' ' ' MET . 2.5 tptm -75.6 -35.65 60.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 117.034 0.417 . . . . 0.0 111.686 -177.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.661 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 41.2 mt -54.02 -59.48 2.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.139 -179.37 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' THR . . . . . 1.028 ' HA ' HD22 ' A' ' 28' ' ' LEU . 11.0 t -47.82 -43.12 27.71 Favored 'General case' 0 CA--C 1.522 -0.129 0 CA-C-O 120.85 0.357 . . . . 0.0 110.444 178.863 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.696 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -48.23 -71.79 0.53 Allowed Glycine 0 N--CA 1.45 -0.396 0 CA-C-N 115.738 -0.665 . . . . 0.0 113.232 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.628 ' HE3' HG23 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -55.7 -43.41 76.44 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 117.035 0.417 . . . . 0.0 111.723 -178.399 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.519 ' CD1' ' HB2' ' B' ' 7' ' ' ASN . 3.1 mm? -79.84 5.64 13.15 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.682 0.253 . . . . 0.0 111.682 -178.517 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.64 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.17 -12.02 53.23 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.868 0.366 . . . . 0.0 110.605 179.627 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.449 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.1 mm-40 -78.0 17.65 0.57 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.364 177.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.419 ' HB ' ' O ' ' A' ' 47' ' ' LEU . 0.9 OUTLIER -83.45 159.46 3.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.1 -179.398 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.613 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 3.9 m-20 -71.01 151.1 44.96 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -178.064 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.806 ' HA ' HD23 ' A' ' 55' ' ' LEU . 2.2 t-20 -80.52 -30.51 37.19 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.679 177.016 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 39.6 m -73.99 -31.87 63.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.662 177.597 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.613 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 0.9 OUTLIER -76.55 -27.87 56.08 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.536 178.746 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.806 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -59.39 -48.73 80.51 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.355 179.841 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.468 ' HA ' HD22 ' A' ' 56' ' ' LEU . 0.9 OUTLIER -60.7 -43.61 97.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.551 179.614 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -59.59 -32.57 70.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.22 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.473 ' HB3' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -65.94 -45.41 81.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.324 -179.408 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.604 HD23 ' CG ' ' A' ' 27' ' ' ARG . 0.2 OUTLIER -67.15 -16.19 64.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.261 -179.524 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -98.79 -11.13 22.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.869 0.366 . . . . 0.0 110.915 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.59 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -123.68 86.48 52.85 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.864 179.859 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -60.35 -33.37 94.41 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.368 2.045 . . . . 0.0 112.216 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.598 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -77.98 -44.99 25.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.193 -179.723 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.598 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 14.5 m -73.83 -25.97 60.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.934 0.397 . . . . 0.0 111.051 -179.521 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.592 HD11 HD13 ' A' ' 31' ' ' LEU . 1.9 tp -78.76 -65.69 0.96 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.621 -178.896 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.596 ' HE ' ' HE2' ' A' ' 35' ' ' MET . 0.1 OUTLIER -51.4 -28.09 11.79 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.973 -178.0 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.576 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 28.7 t -69.42 -42.68 74.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.149 0.499 . . . . 0.0 110.094 178.129 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.655 ' HG2' HD21 ' B' ' 6' ' ' LEU . 2.5 ttmm -66.08 -57.22 8.2 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.55 179.278 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.542 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 52.9 t -64.11 -18.73 23.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.636 179.289 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.616 ' O ' HG22 ' A' ' 73' ' ' VAL . 21.9 t70 -55.65 -49.95 71.52 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 176.552 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.507 ' HB3' HD13 ' B' ' 6' ' ' LEU . 25.7 tt0 -68.53 -24.94 64.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.771 177.159 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.712 ' O ' HG22 ' A' ' 75' ' ' VAL . . . -63.26 -50.58 69.62 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.191 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.616 HG22 ' O ' ' A' ' 70' ' ' ASP . 3.7 m -58.15 -29.19 36.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 178.178 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.413 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -70.09 -36.75 75.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.083 179.004 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.712 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.3 m -59.67 -31.92 48.16 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.123 0 CA-C-O 121.078 0.466 . . . . 0.0 110.016 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.61 HD12 HG22 ' A' ' 38' ' ' THR . 2.4 tm? -71.91 -49.85 34.29 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.317 178.228 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -54.44 -39.82 67.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.51 179.479 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.48 -19.62 41.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.095 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 0.434 ' HB2' ' O ' ' A' ' 75' ' ' VAL . 4.0 t60 . . . . . 0 C--N 1.331 -0.209 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.016 -179.398 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 5' ' ' ASN . . . . . 0.503 ' HB2' HG12 ' A' ' 75' ' ' VAL . 62.5 m-20 . . . . . 0 C--O 1.233 0.2 0 CA-C-O 120.738 0.304 . . . . 0.0 111.291 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.655 HD21 ' HG2' ' A' ' 68' ' ' LYS . 6.0 tp -62.43 -82.44 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.612 -179.778 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 7' ' ' ASN . . . . . 0.519 ' HB2' ' CD1' ' A' ' 47' ' ' LEU . 1.5 t-20 -75.22 136.46 72.42 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.651 178.665 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.72 -10.72 18.49 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 122.117 1.878 . . . . 0.0 111.819 178.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 9' ' ' ASN . . . . . 0.541 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 4.0 m120 -123.93 63.25 1.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.769 179.777 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 10' ' ' ALA . . . . . 0.474 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.15 92.06 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.561 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.541 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.2 OUTLIER -118.66 123.64 45.43 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.284 178.592 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 12' ' ' GLU . . . . . 0.514 ' HG2' ' HE3' ' A' ' 42' ' ' LYS . 8.5 mt-10 -47.97 172.14 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.251 0.548 . . . . 0.0 112.366 -178.149 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 13' ' ' PHE . . . . . 0.696 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.5 OUTLIER . . . . . 0 C--N 1.332 -0.156 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.799 179.088 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 4.3 mtmp? . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.879 0.371 . . . . 0.0 110.985 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 1.2 t80 . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.049 -179.648 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.729 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 4.8 t . . . . . 0 N--CA 1.456 -0.173 0 CA-C-O 120.541 0.21 . . . . 0.0 110.552 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.451 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.45 -39.02 82.26 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 177.167 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.14 -34.83 73.54 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.651 177.221 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.729 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 3.2 mtm -64.46 -34.78 78.99 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.765 177.545 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.646 HD21 ' NH1' ' A' ' 27' ' ' ARG . 1.9 mp -52.58 -52.18 56.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.111 178.631 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.88 -26.25 67.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.781 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -101.83 15.78 27.93 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.699 -179.005 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.98 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 CA--C 1.532 0.276 0 CA-C-N 116.71 -0.223 . . . . 0.0 111.446 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.98 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 2.1 tp10 . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 120.822 0.344 . . . . 0.0 110.817 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.506 ' NE2' ' HE3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -53.47 -62.79 1.42 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.356 -179.468 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.462 ' H ' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -55.63 -20.68 14.67 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.361 -178.079 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.691 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 13.9 tp60 -73.94 -78.63 0.09 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.04 0.448 . . . . 0.0 111.37 178.636 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' MET . . . . . 0.613 ' SD ' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.24 -96.35 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -176.665 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.589 ' HB2' ' CG ' ' A' ' 30' ' ' PRO . 0.4 OUTLIER -61.4 1.52 0.2 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -175.038 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.532 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 65.08 -117.18 9.86 Favored Glycine 0 N--CA 1.444 -0.794 0 N-CA-C 108.344 -1.903 . . . . 0.0 108.344 -174.3 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.425 ' O ' HD13 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -75.9 -66.81 0.74 Allowed 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 169.345 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.905 ' HG3' HD21 ' A' ' 31' ' ' LEU . 22.1 tpt180 -160.36 5.51 0.08 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.273 -1.33 . . . . 0.0 107.89 176.565 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.971 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.28 -74.6 0.07 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.169 -1.378 . . . . 0.0 114.394 -172.554 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.715 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.2 OUTLIER -33.17 -49.1 0.64 Allowed Pre-proline 0 CA--C 1.542 0.639 0 N-CA-C 113.256 0.835 . . . . 0.0 113.256 -175.204 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.589 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 38.0 Cg_exo -61.82 -40.15 46.94 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 122.513 2.142 . . . . 0.0 113.669 -178.845 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.976 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.13 -47.76 60.36 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 -179.347 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.646 HD11 HD23 ' A' ' 28' ' ' LEU . 0.5 OUTLIER -73.1 -13.2 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.637 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.878 177.478 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.654 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 45.7 tt0 -62.41 -41.04 98.38 Favored 'General case' 0 CA--C 1.518 -0.256 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 177.594 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.85 -29.97 70.02 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 175.249 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' MET . . . . . 0.533 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 4.7 mtt -101.75 26.19 7.72 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.23 178.191 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.654 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 3.2 p-80 -62.38 -32.76 10.07 Favored Pre-proline 0 CA--C 1.537 0.479 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -176.793 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.558 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 55.0 Cg_exo -36.43 -30.78 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.282 0 C-N-CA 122.151 1.901 . . . . 0.0 112.211 179.171 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.799 HG21 HG13 ' A' ' 73' ' ' VAL . 3.5 m -78.21 -89.13 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.73 176.474 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.518 HD12 ' H ' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -171.51 59.44 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.168 177.975 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.467 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -43.57 -39.47 3.49 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.6 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.6 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.83 -56.49 9.83 Favored Glycine 0 C--N 1.329 0.186 0 CA-C-N 116.044 -0.525 . . . . 0.0 113.818 -179.186 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.643 ' HE2' ' SD ' ' A' ' 46' ' ' MET . 2.8 tptm -77.46 -37.48 51.36 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 -178.048 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.644 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 45.7 mt -53.74 -57.0 6.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.007 -178.77 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.971 ' HA ' HD22 ' A' ' 28' ' ' LEU . 9.8 t -49.25 -40.25 33.41 Favored 'General case' 0 N--CA 1.457 -0.115 0 CA-C-O 121.006 0.432 . . . . 0.0 110.073 177.959 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.752 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -50.33 -68.68 1.33 Allowed Glycine 0 N--CA 1.45 -0.426 0 CA-C-N 115.572 -0.74 . . . . 0.0 112.927 179.635 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.643 ' SD ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.19 -46.4 75.85 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -178.5 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.526 HD12 ' HB2' ' B' ' 7' ' ' ASN . 2.8 mm? -80.23 7.29 9.72 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 111.698 0.259 . . . . 0.0 111.698 -179.063 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.631 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.23 -13.24 60.03 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.9 0.381 . . . . 0.0 110.637 179.585 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.546 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 3.3 mt-10 -78.3 19.28 0.46 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.484 178.252 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.864 HD11 ' NZ ' ' A' ' 68' ' ' LYS . 2.3 tt -83.12 163.5 2.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.02 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.685 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 3.6 m-20 -71.12 158.95 35.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.731 -179.418 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.771 ' HA ' HD23 ' A' ' 55' ' ' LEU . 4.8 m120 -88.41 -29.08 20.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.837 -0.619 . . . . 0.0 109.676 176.788 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.91 -30.36 62.55 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 177.025 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.685 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 0.4 OUTLIER -76.93 -29.2 55.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.522 178.675 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.771 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -59.32 -47.49 85.2 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.986 0.422 . . . . 0.0 110.364 179.777 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.444 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 1.3 tm? -60.7 -41.65 95.62 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.474 179.213 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.538 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 0.2 OUTLIER -61.69 -41.8 98.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.615 179.101 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.59 ' HE2' ' HA ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -62.09 -36.72 82.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.128 178.749 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.783 HD12 ' NE ' ' A' ' 27' ' ' ARG . 4.4 tt -71.09 -19.79 62.42 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.407 178.723 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.538 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 2.6 pt-20 -106.01 -2.46 22.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.148 -179.64 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.59 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 9.1 m -123.16 78.87 52.23 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.933 -179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -55.79 -36.47 95.31 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.124 1.883 . . . . 0.0 112.059 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.459 ' HG2' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.7 -46.6 18.68 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.883 -179.065 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.59 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 14.1 m -71.15 -50.46 33.18 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.952 0.406 . . . . 0.0 111.311 -178.008 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.976 HD21 HD13 ' A' ' 31' ' ' LEU . 0.0 OUTLIER -57.95 -56.9 16.05 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.874 -179.242 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.639 ' N ' HD13 ' A' ' 65' ' ' LEU . 2.2 ttm180 -51.56 -30.78 22.03 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.744 -178.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.502 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 5.9 t -69.66 -38.54 77.14 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.031 0.444 . . . . 0.0 110.327 178.322 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.864 ' NZ ' HD11 ' A' ' 50' ' ' ILE . 8.7 mtpp -65.41 -58.55 5.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.189 178.9 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.46 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 49.5 t -62.75 -21.58 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.616 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.502 ' HB3' ' O ' ' A' ' 67' ' ' SER . 13.4 t0 -54.46 -48.97 71.14 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 177.089 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.436 ' O ' HG13 ' A' ' 75' ' ' VAL . 21.6 tt0 -68.76 -32.62 72.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.602 176.725 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.644 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -58.29 -35.32 71.63 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.393 178.217 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.799 HG13 HG21 ' A' ' 38' ' ' THR . 25.3 t -67.0 -33.02 60.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.662 177.613 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.35 -38.01 71.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.123 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.58 HG22 ' O ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -56.78 -33.38 40.81 Favored 'Isoleucine or valine' 0 C--O 1.231 0.092 0 CA-C-O 121.187 0.517 . . . . 0.0 109.916 179.17 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.744 HD12 HG22 ' A' ' 38' ' ' THR . 2.9 tm? -69.37 -49.87 51.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.525 178.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -54.14 -35.44 62.23 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.601 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.0 -26.85 36.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.705 178.799 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 5.0 t60 . . . . . 0 C--N 1.332 -0.164 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.797 179.63 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 15.6 m120 . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.88 0.372 . . . . 0.0 110.702 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.439 HD12 ' HA ' ' B' ' 6' ' ' LEU . 3.3 tp -70.84 -83.23 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.601 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 7' ' ' ASN . . . . . 0.526 ' HB2' HD12 ' A' ' 47' ' ' LEU . 1.5 t-20 -76.02 134.43 71.35 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.694 178.884 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -79.87 -8.32 14.46 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 122.327 2.018 . . . . 0.0 112.305 179.732 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 9' ' ' ASN . . . . . 0.419 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 73.9 m-20 -123.67 57.46 1.18 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.012 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.15 95.88 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.379 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.546 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -125.01 131.82 53.34 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.585 179.004 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -47.66 167.68 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 121.2 0.524 . . . . 0.0 112.301 -178.366 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 13' ' ' PHE . . . . . 0.752 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.6 OUTLIER . . . . . 0 C--N 1.332 -0.178 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.69 179.126 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 18' ' ' LYS . . . . . 0.506 ' HE3' ' NE2' ' A' ' 20' ' ' GLN . 3.6 mttp . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.822 0.344 . . . . 0.0 110.84 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.405 ' HD1' ' HA ' ' B' ' 19' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.841 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.782 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 5.2 t . . . . . 0 CA--C 1.52 -0.186 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.14 -37.07 76.37 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 176.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 17.3 t -70.1 -35.92 74.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.566 177.01 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.782 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 8.7 mtm -64.43 -35.52 81.19 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.129 177.732 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.558 ' HA ' ' HE2' ' A' ' 23' ' ' MET . 44.7 mt -52.71 -50.19 63.85 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.915 179.054 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.18 -28.83 69.06 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.875 177.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -101.76 23.92 10.63 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.931 -178.537 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.637 ' HB1' ' CB ' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.33 -0.263 0 CA-C-O 120.626 0.251 . . . . 0.0 110.851 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.637 ' CB ' ' HB1' ' A' ' 15' ' ' ALA . 1.9 mm-40 . . . . . 0 N--CA 1.451 -0.421 0 CA-C-O 120.373 0.13 . . . . 0.0 111.086 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.516 ' O ' HD12 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -46.9 -56.49 6.25 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.412 -177.917 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.15 -29.02 60.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.176 -179.163 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 14.9 tp60 -72.65 -73.86 0.19 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.483 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' MET . . . . . 0.594 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.41 -97.87 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -176.926 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.686 HD22 ' HD3' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -62.22 3.65 0.17 Allowed 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -174.914 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.5 -118.7 13.22 Favored Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 108.274 -1.931 . . . . 0.0 108.274 -174.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.624 ' HG2' HG22 ' A' ' 50' ' ' ILE . 0.4 OUTLIER -75.59 -66.37 0.79 Allowed 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 106.962 -1.496 . . . . 0.0 106.962 168.105 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.686 ' HD3' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -159.81 5.99 0.09 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.009 -1.45 . . . . 0.0 108.0 174.164 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.902 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.4 OUTLIER -59.64 -77.62 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.271 -1.331 . . . . 0.0 114.354 -173.061 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.576 ' CD2' HG21 ' A' ' 44' ' ' THR . 0.1 OUTLIER -33.15 -48.45 0.61 Allowed Pre-proline 0 CA--C 1.539 0.538 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -174.636 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.586 ' HD3' ' HA ' ' A' ' 24' ' ' LEU . 19.2 Cg_endo -62.13 -43.45 24.09 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.22 1.947 . . . . 0.0 113.448 -178.463 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.805 HD13 HG21 ' A' ' 69' ' ' VAL . 0.0 OUTLIER -71.32 -44.62 64.77 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 119.816 -0.754 . . . . 0.0 109.984 -179.645 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.576 HD11 HD23 ' A' ' 28' ' ' LEU . 0.5 OUTLIER -72.23 -13.34 16.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 177.689 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.641 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 57.7 tp60 -62.53 -41.75 99.07 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 176.826 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.83 -28.03 68.03 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 175.085 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' MET . . . . . 0.524 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 5.9 mtt -102.75 25.4 9.26 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.228 178.291 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.641 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 2.2 p-80 -64.39 -31.69 6.23 Favored Pre-proline 0 CA--C 1.536 0.421 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -176.526 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.561 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 51.8 Cg_exo -36.11 -31.74 0.1 OUTLIER 'Trans proline' 0 C--N 1.363 1.318 0 C-N-CA 122.125 1.884 . . . . 0.0 112.061 179.136 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.802 HG21 HG13 ' A' ' 73' ' ' VAL . 6.9 m -78.21 -88.92 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.578 176.144 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.616 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 7.7 tp -171.7 62.64 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.131 177.371 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.487 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -45.02 -41.2 7.22 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.544 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.526 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -52.17 -51.62 40.4 Favored Glycine 0 C--N 1.329 0.192 0 C-N-CA 121.172 -0.537 . . . . 0.0 113.587 -179.222 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.46 ' HA ' ' HD2' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -77.42 -40.44 43.49 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 122.719 -0.283 . . . . 0.0 111.68 -178.594 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.64 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 65.7 mt -53.7 -54.53 18.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.83 -179.733 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.902 ' HA ' HD22 ' A' ' 28' ' ' LEU . 11.4 t -53.47 -41.26 66.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.362 178.918 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.647 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -51.62 -67.45 1.99 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 121.009 -0.615 . . . . 0.0 112.85 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.557 ' HG3' HD22 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -55.35 -47.0 76.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.712 0.256 . . . . 0.0 111.575 -179.022 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.557 HD22 ' HG3' ' A' ' 46' ' ' MET . 3.1 mm? -80.28 8.23 7.85 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.625 0.231 . . . . 0.0 111.625 -179.216 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.647 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.1 OUTLIER -64.54 -13.26 51.81 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 121.017 0.437 . . . . 0.0 110.111 179.406 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.483 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.5 mt-10 -78.67 20.64 0.43 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.377 177.211 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.624 HG22 ' HG2' ' A' ' 26' ' ' GLU . 0.3 OUTLIER -83.26 157.03 3.79 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.672 -179.457 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.65 155.47 40.46 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.905 0.383 . . . . 0.0 111.745 -178.278 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.895 ' HA ' HD23 ' A' ' 55' ' ' LEU . 7.2 m-80 -85.61 -28.98 24.45 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.06 177.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 62.6 m -74.19 -29.96 62.0 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.721 177.748 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.566 ' O ' ' HG2' ' A' ' 58' ' ' MET . 2.6 mm-40 -79.88 -29.39 39.96 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.638 179.062 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.895 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -58.99 -46.88 87.05 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.132 179.757 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.458 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 26.9 tp -62.16 -45.55 92.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.617 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -59.62 -28.49 67.26 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.17 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.629 ' SD ' ' HA ' ' A' ' 65' ' ' LEU . 32.1 mmt -69.51 -49.05 58.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.377 -179.375 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.528 ' HG ' ' CZ ' ' A' ' 27' ' ' ARG . 0.2 OUTLIER -64.38 -21.23 66.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.092 -179.576 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -96.38 -4.56 41.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.062 0.458 . . . . 0.0 110.41 178.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.58 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 11.9 m -124.18 78.39 59.96 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.803 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -55.79 -33.73 88.99 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.138 1.892 . . . . 0.0 112.146 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -78.13 -49.44 13.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.828 -179.374 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.58 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 39.2 m -69.45 -45.38 69.21 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.853 0.359 . . . . 0.0 111.444 -178.272 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.658 HD11 HD13 ' A' ' 31' ' ' LEU . 0.6 OUTLIER -57.92 -66.72 0.43 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.409 -178.835 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.65 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -47.06 -31.47 3.38 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.924 -178.884 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.529 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.5 OUTLIER -65.36 -44.27 88.18 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.164 0.507 . . . . 0.0 109.986 177.714 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.512 ' O ' HD11 ' B' ' 6' ' ' LEU . 0.2 OUTLIER -65.86 -59.85 3.45 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.555 178.791 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.805 HG21 HD13 ' A' ' 31' ' ' LEU . 78.8 t -61.05 -19.67 20.46 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.018 179.608 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.529 ' HB3' ' O ' ' A' ' 67' ' ' SER . 7.1 t70 -55.7 -49.42 73.06 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 176.174 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.458 ' O ' HG13 ' A' ' 75' ' ' VAL . 22.2 tt0 -66.12 -32.53 74.03 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.677 176.239 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.65 ' O ' HG22 ' A' ' 75' ' ' VAL . . . -57.74 -37.07 72.97 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.31 178.639 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.802 HG13 HG21 ' A' ' 38' ' ' THR . 24.6 t -65.04 -32.57 58.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.642 177.465 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.05 -36.62 66.93 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.205 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.65 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.85 -29.45 40.49 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.129 0 CA-C-O 121.02 0.438 . . . . 0.0 110.098 179.111 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.633 HD12 HG22 ' A' ' 38' ' ' THR . 2.6 tm? -70.34 -51.01 33.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.375 178.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -58.06 -35.54 71.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.457 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.27 -17.91 47.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.006 179.13 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.966 -179.896 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 5' ' ' ASN . . . . . 0.593 ' HB2' HG12 ' A' ' 75' ' ' VAL . 2.6 m-80 . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.682 0.277 . . . . 0.0 110.914 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.512 HD11 ' O ' ' A' ' 68' ' ' LYS . 3.4 mt -62.72 -80.18 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.583 179.572 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 7' ' ' ASN . . . . . 0.408 ' HB2' ' CD1' ' A' ' 47' ' ' LEU . 1.6 t-20 -75.02 142.34 75.95 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.556 178.853 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -78.98 -12.18 14.71 Favored 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.318 2.012 . . . . 0.0 112.122 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 9' ' ' ASN . . . . . 0.585 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 69.9 m-20 -123.96 60.72 1.11 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.163 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.86 96.11 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.616 179.535 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.585 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.0 OUTLIER -122.47 129.05 51.61 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.37 178.433 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -48.17 173.44 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.115 0.483 . . . . 0.0 112.126 -178.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 13' ' ' PHE . . . . . 0.483 ' CE1' ' HG ' ' A' ' 48' ' ' LEU . 0.3 OUTLIER . . . . . 0 CA--C 1.519 -0.248 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.867 179.393 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 7.6 mttt . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.89 0.376 . . . . 0.0 110.63 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 1.7 t80 . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.941 -179.324 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.849 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 10.8 t . . . . . 0 N--CA 1.457 -0.123 0 CA-C-O 120.647 0.26 . . . . 0.0 110.473 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.435 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.45 -37.2 77.55 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 176.718 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.3 t -70.56 -33.77 71.48 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.591 177.01 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.849 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.3 mtm -64.09 -35.74 81.75 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 177.676 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.559 HD11 ' HB3' ' A' ' 24' ' ' LEU . 1.7 mp -52.32 -54.27 33.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.02 178.637 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.31 -26.68 67.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.244 178.709 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.7 p -101.64 15.57 28.51 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.881 -178.267 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.674 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.329 -0.314 0 CA-C-O 120.583 0.23 . . . . 0.0 111.209 -179.721 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.674 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.804 0.335 . . . . 0.0 110.947 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.517 ' NE2' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -54.24 -65.47 0.57 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.265 -179.55 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.618 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -56.34 -19.59 15.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.733 -177.693 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.618 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 16.6 tp60 -72.72 -80.59 0.06 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.028 0.442 . . . . 0.0 111.322 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' MET . . . . . 0.663 ' HE2' ' HB3' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -69.91 -95.41 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.658 -177.374 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.582 ' HB2' ' CG ' ' A' ' 30' ' ' PRO . 0.4 OUTLIER -62.46 -2.38 1.04 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -175.06 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.561 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 65.29 -116.35 8.71 Favored Glycine 0 N--CA 1.445 -0.763 0 N-CA-C 108.419 -1.872 . . . . 0.0 108.419 -173.77 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.65 -69.88 0.49 Allowed 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 169.407 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.699 ' HD2' ' HG2' ' A' ' 30' ' ' PRO . 12.8 tpt180 -160.11 14.33 0.13 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.325 -1.307 . . . . 0.0 107.951 175.876 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.556 ' O ' HG13 ' A' ' 32' ' ' ILE . 3.9 mm? -57.76 -76.2 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.423 -1.262 . . . . 0.0 113.329 -174.281 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.634 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -39.02 -47.11 3.68 Favored Pre-proline 0 CA--C 1.538 0.517 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -175.815 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.699 ' HG2' ' HD2' ' A' ' 27' ' ' ARG . 52.1 Cg_exo -57.36 -43.31 53.2 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.333 2.022 . . . . 0.0 113.817 -178.145 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.881 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.58 -47.44 60.24 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.395 0.617 . . . . 0.0 109.955 -178.488 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.771 HG21 HD12 ' A' ' 43' ' ' ILE . 0.7 OUTLIER -73.99 -13.15 15.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.227 178.468 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.647 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 3.6 tm0? -62.54 -40.85 98.1 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 176.834 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.13 -30.06 70.47 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 174.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' MET . . . . . 0.486 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 6.6 mtt -101.69 25.93 7.96 Favored 'General case' 0 N--CA 1.461 0.09 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.443 178.199 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.647 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.8 p-80 -65.32 -32.87 6.85 Favored Pre-proline 0 CA--C 1.535 0.392 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 -177.329 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.573 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 57.3 Cg_exo -36.69 -33.01 0.13 Allowed 'Trans proline' 0 C--N 1.36 1.181 0 C-N-CA 122.183 1.922 . . . . 0.0 112.182 179.407 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.473 ' HB ' ' H ' ' A' ' 39' ' ' LEU . 1.1 m -79.06 -86.31 0.07 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.982 -0.553 . . . . 0.0 109.732 176.573 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.599 ' HB2' HD13 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -171.36 65.03 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.194 0 CA-C-O 120.719 0.295 . . . . 0.0 111.371 177.982 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.543 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -52.62 -29.1 24.24 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.127 179.165 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.62 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -49.49 -56.83 10.24 Favored Glycine 0 N--CA 1.452 -0.234 0 CA-C-N 115.805 -0.634 . . . . 0.0 114.053 -178.38 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.609 ' O ' ' HG2' ' A' ' 46' ' ' MET . 0.0 OUTLIER -77.93 -37.99 46.47 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -177.345 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.792 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 22.0 mt -53.18 -54.19 18.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 C-N-CA 120.952 -0.299 . . . . 0.0 111.562 -177.719 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.542 HG21 ' CD2' ' A' ' 29' ' ' PHE . 5.1 t -46.8 -49.46 19.89 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.44 ' N ' HG23 ' A' ' 44' ' ' THR . . . -55.16 -48.56 67.56 Favored Glycine 0 N--CA 1.449 -0.451 0 CA-C-N 115.878 -0.601 . . . . 0.0 112.796 178.615 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.716 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.2 OUTLIER -54.94 -69.78 0.12 Allowed 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.461 0.648 . . . . 0.0 111.066 -179.079 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.855 HD23 ' HB2' ' B' ' 7' ' ' ASN . 2.5 mp -80.03 17.64 0.96 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.832 -177.142 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.592 ' HB3' ' HD2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -65.98 -23.47 66.59 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 121.161 0.505 . . . . 0.0 109.755 177.009 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.547 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 1.2 mt-10 -74.58 23.46 0.09 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.01 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.625 HD11 ' HE3' ' A' ' 68' ' ' LYS . 3.5 tt -84.7 169.52 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.932 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.541 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 30.6 m-20 -70.96 159.59 34.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.615 -179.569 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.85 ' HA ' HD23 ' A' ' 55' ' ' LEU . 26.3 m-80 -89.09 -28.31 20.19 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.897 177.232 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -74.05 -30.15 62.26 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 177.144 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.541 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 1.2 mm-40 -78.87 -28.77 44.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.656 178.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.85 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -59.18 -45.93 89.73 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.07 179.6 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.53 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 7.1 tt -60.1 -49.97 75.54 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.6 179.022 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -58.59 -32.05 68.61 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.284 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.565 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -62.85 -55.62 24.66 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.067 -179.77 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 56' ' ' LEU . 2.3 pp -66.14 -6.21 12.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.028 0.442 . . . . 0.0 110.369 178.62 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.522 ' O ' ' HG3' ' A' ' 60' ' ' GLU . 9.4 tp10 -105.12 -13.95 15.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.606 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.534 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -122.66 91.37 49.56 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.966 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.408 ' HD2' ' HA ' ' A' ' 61' ' ' SER . 32.2 Cg_endo -63.79 -31.25 68.57 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.303 2.002 . . . . 0.0 112.151 179.537 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.573 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.61 -45.44 21.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.15 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.573 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 19.1 m -72.73 -56.36 5.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.011 0.434 . . . . 0.0 111.537 -178.633 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.881 HD21 HD13 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -57.86 -60.69 3.32 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.621 -177.999 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.703 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -51.78 -35.41 43.72 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.22 -177.752 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.533 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 2.8 m -65.52 -37.76 87.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.102 0.477 . . . . 0.0 110.194 178.23 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.625 ' HE3' HD11 ' A' ' 50' ' ' ILE . 0.5 OUTLIER -66.39 -55.08 17.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.574 179.019 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.626 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 61.4 t -67.99 -16.14 20.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.564 179.504 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.588 ' O ' HG22 ' A' ' 73' ' ' VAL . 8.7 t70 -58.04 -49.46 76.8 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 176.101 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.529 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 0.4 OUTLIER -68.9 -20.07 64.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.734 176.354 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.792 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -65.63 -47.72 74.64 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.732 179.434 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.588 HG22 ' O ' ' A' ' 70' ' ' ASP . 2.4 m -57.17 -30.5 34.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 176.62 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.529 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -68.33 -32.18 72.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.837 178.403 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.682 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.2 m -60.81 -30.91 48.17 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.131 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 178.926 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.599 HD13 ' HB2' ' A' ' 39' ' ' LEU . 30.6 mt -67.82 -50.55 56.11 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.271 0.557 . . . . 0.0 109.602 176.276 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -51.53 -39.18 57.21 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.343 179.099 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.93 -25.11 35.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.848 177.866 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 . . . . . 0 C--N 1.332 -0.164 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.956 -179.557 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.457 -0.11 0 CA-C-O 120.852 0.358 . . . . 0.0 110.981 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.616 ' HB3' HD21 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -82.78 -79.0 0.2 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.818 179.678 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 7' ' ' ASN . . . . . 0.855 ' HB2' HD23 ' A' ' 47' ' ' LEU . 1.5 t-20 -84.98 127.63 63.76 Favored Pre-proline 0 C--N 1.331 -0.219 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.129 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -80.17 13.48 2.19 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 122.357 2.038 . . . . 0.0 111.884 178.436 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 9' ' ' ASN . . . . . 0.526 ' HB3' ' OE2' ' A' ' 49' ' ' GLU . 25.8 m-20 -123.61 28.31 7.02 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.31 -179.501 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 10' ' ' ALA . . . . . 0.716 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -59.39 96.41 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.818 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.547 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 1.7 mttp -130.11 -178.4 4.72 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.473 178.682 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -68.87 161.34 28.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.658 0.266 . . . . 0.0 111.061 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 13' ' ' PHE . . . . . 0.407 ' HB2' ' CA ' ' A' ' 45' ' ' GLY . 1.0 OUTLIER . . . . . 0 C--O 1.232 0.173 0 CA-C-O 120.957 0.408 . . . . 0.0 110.697 179.427 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 24.0 mttp . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.813 0.339 . . . . 0.0 110.516 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.592 ' HD2' ' HB3' ' A' ' 48' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.983 -179.449 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.797 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 8.0 t . . . . . 0 CA--C 1.522 -0.112 0 CA-C-O 120.51 0.195 . . . . 0.0 110.718 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.471 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.55 -38.31 80.73 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 176.703 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.9 t -67.61 -35.04 78.21 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.459 -0.792 . . . . 0.0 109.347 176.584 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.797 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.7 mtm -64.42 -34.58 78.52 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.945 177.477 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.487 HD11 HD23 ' A' ' 24' ' ' LEU . 1.2 mp -54.88 -44.83 74.41 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.367 179.036 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.3 -37.18 84.82 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.884 178.615 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.28 47.02 0.92 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.989 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.77 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 CA--C 1.537 0.461 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -177.829 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.77 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 1.4 tp10 . . . . . 0 N--CA 1.461 0.089 0 CA-C-O 120.631 0.253 . . . . 0.0 110.838 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.47 ' O ' HD12 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -46.88 -55.67 7.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.34 -178.386 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.722 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -56.26 -24.2 41.24 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.84 -178.571 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.558 ' H ' ' HD3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -72.54 -78.36 0.09 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.899 0.38 . . . . 0.0 111.862 -179.299 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 23' ' ' MET . . . . . 0.563 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.29 -95.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -176.37 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.563 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -60.39 -0.23 0.23 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -175.353 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 65.18 -115.69 8.02 Favored Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 108.431 -1.868 . . . . 0.0 108.431 -174.228 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.589 ' HG2' HG22 ' A' ' 50' ' ' ILE . 0.5 OUTLIER -75.52 -70.11 0.45 Allowed 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 168.64 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.699 ' HB2' HD13 ' A' ' 55' ' ' LEU . 12.7 tpt85 -160.37 10.53 0.1 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.152 -1.385 . . . . 0.0 107.67 174.499 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.995 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -58.88 -72.62 0.1 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 114.236 -1.347 . . . . 0.0 113.778 -173.025 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.675 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -35.81 -49.31 1.48 Allowed Pre-proline 0 CA--C 1.538 0.503 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -176.134 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.508 ' O ' ' HB3' ' A' ' 33' ' ' GLN . 53.0 Cg_exo -58.69 -42.39 54.19 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.436 2.091 . . . . 0.0 113.633 -178.708 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.944 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.09 -47.64 61.03 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.07 0.462 . . . . 0.0 109.998 -178.559 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.882 HG21 HD12 ' A' ' 43' ' ' ILE . 0.5 OUTLIER -75.07 -12.06 14.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.199 178.258 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.613 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 50.3 tp60 -62.39 -39.23 92.54 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 177.174 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.58 -30.23 67.95 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.011 174.589 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' MET . . . . . 0.582 ' HE1' ' HA ' ' A' ' 66' ' ' ARG . 6.7 mtt -100.55 28.25 5.22 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.333 178.116 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.613 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -64.96 -31.33 5.26 Favored Pre-proline 0 CA--C 1.536 0.433 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.324 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.593 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 55.7 Cg_exo -35.28 -33.03 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.265 0 C-N-CA 122.365 2.043 . . . . 0.0 112.535 179.549 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.402 ' N ' ' O ' ' A' ' 36' ' ' HIS . 67.8 m -78.18 -85.31 0.07 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.122 177.377 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.579 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.2 OUTLIER -171.19 50.85 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.547 179.014 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.484 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -37.02 -38.81 0.2 Allowed 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -179.536 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.675 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -44.23 -63.74 2.25 Favored Glycine 0 C--N 1.33 0.206 0 CA-C-N 115.998 -0.546 . . . . 0.0 114.208 -179.265 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.845 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.8 OUTLIER -77.48 -27.56 52.0 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.257 0.465 . . . . 0.0 112.257 -177.267 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.882 HD12 HG21 ' A' ' 32' ' ' ILE . 1.2 mt -54.01 -50.51 53.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.662 0.268 . . . . 0.0 111.195 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.995 ' HA ' HD22 ' A' ' 28' ' ' LEU . 10.6 t -55.4 -46.38 76.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.58 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.594 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -50.05 -59.38 7.58 Favored Glycine 0 N--CA 1.452 -0.253 0 CA-C-N 115.986 -0.552 . . . . 0.0 113.234 -179.732 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.522 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -56.89 -53.51 57.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.659 0.266 . . . . 0.0 111.371 -178.92 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.542 ' HB2' HD21 ' A' ' 28' ' ' LEU . 2.8 mm? -80.3 10.97 3.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.767 -178.836 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.594 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.48 -20.53 66.39 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.827 0.346 . . . . 0.0 110.613 179.711 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.449 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.2 mt-10 -76.0 21.54 0.17 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.793 179.222 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.589 HG22 ' HG2' ' A' ' 26' ' ' GLU . 0.2 OUTLIER -83.55 163.41 2.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.915 -179.669 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.493 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 1.3 m-20 -70.61 155.67 40.44 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.763 -178.928 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.873 ' HA ' HD23 ' A' ' 55' ' ' LEU . 17.4 m-80 -84.87 -29.94 24.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.861 177.418 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.502 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 18.3 m -74.09 -28.49 61.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.298 0.57 . . . . 0.0 109.677 177.021 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.537 ' O ' ' HG2' ' A' ' 58' ' ' MET . 0.2 OUTLIER -80.16 -28.28 38.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.402 178.839 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.873 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.8 OUTLIER -59.7 -47.52 85.33 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.684 -179.699 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.533 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 1.0 OUTLIER -64.31 -43.24 95.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.725 179.955 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 9.1 m-70 -58.8 -21.83 56.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.118 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.638 ' HB3' ' HG ' ' A' ' 65' ' ' LEU . 28.2 mmt -76.59 -49.54 16.07 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.472 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.58 HD22 ' HE ' ' A' ' 27' ' ' ARG . 2.6 pp -66.14 -10.63 42.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.673 0.273 . . . . 0.0 110.895 -179.703 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -106.8 -5.52 18.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.707 178.902 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.6 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 3.6 m -122.52 81.83 47.14 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.946 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -58.49 -33.74 98.23 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.239 1.959 . . . . 0.0 111.83 179.272 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -78.51 -48.84 14.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.82 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.6 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 15.5 m -70.98 -53.36 15.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.888 0.375 . . . . 0.0 111.533 -177.824 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.944 HD21 HD13 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -58.01 -61.39 2.58 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.434 -178.405 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.681 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.8 OUTLIER -49.69 -34.54 18.89 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.141 -177.679 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 15.1 m -68.37 -39.18 81.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.248 0.547 . . . . 0.0 110.149 178.13 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.615 ' HE2' ' SD ' ' A' ' 58' ' ' MET . 0.2 OUTLIER -65.99 -56.35 12.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.552 179.201 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.544 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 21.0 t -63.87 -20.74 27.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.345 178.805 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.641 ' O ' HG22 ' A' ' 73' ' ' VAL . 21.4 t70 -53.88 -48.68 69.83 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 176.885 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.491 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 1.6 tt0 -68.28 -29.47 68.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.937 176.835 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.586 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -58.35 -47.22 84.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.001 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.843 ' HA ' HD13 ' A' ' 43' ' ' ILE . 2.0 m -58.84 -31.72 45.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 177.56 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -69.03 -39.39 79.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.3 179.711 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.545 HG12 ' HB2' ' B' ' 5' ' ' ASN . 0.9 OUTLIER -55.73 -29.74 25.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-O 120.948 0.404 . . . . 0.0 109.917 179.487 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.845 HD11 ' HB3' ' A' ' 42' ' ' LYS . 3.5 mm? -71.84 -51.01 24.58 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.338 177.341 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 -50.75 -34.76 28.46 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.223 -0.898 . . . . 0.0 110.004 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -82.0 -31.33 31.13 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.684 177.575 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 1.6 t60 . . . . . 0 C--N 1.333 -0.143 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.055 -179.68 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 5' ' ' ASN . . . . . 0.545 ' HB2' HG12 ' A' ' 75' ' ' VAL . 9.7 m120 . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.703 0.287 . . . . 0.0 111.015 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 14.2 mt -64.0 -76.51 0.07 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.765 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 7' ' ' ASN . . . . . 0.491 ' HA ' ' HD3' ' B' ' 8' ' ' PRO . 1.3 t-20 -76.62 126.57 85.87 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.669 179.066 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 8' ' ' PRO . . . . . 0.491 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 4.6 Cg_exo -74.61 -4.46 15.45 Favored 'Trans proline' 0 N--CA 1.46 -0.476 0 C-N-CA 122.307 2.005 . . . . 0.0 112.037 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -123.65 54.8 1.28 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.022 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 10' ' ' ALA . . . . . 0.522 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.27 92.09 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.441 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.449 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 0.1 OUTLIER -109.47 165.76 11.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.628 179.137 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 12' ' ' GLU . . . . . 0.606 ' HG2' ' NZ ' ' A' ' 42' ' ' LYS . 1.8 tm-20 -67.85 165.07 18.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.65 179.374 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 13' ' ' PHE . . . . . 0.514 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.1 t80 . . . . . 0 C--N 1.33 -0.255 0 CA-C-O 120.978 0.418 . . . . 0.0 110.635 179.599 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 18' ' ' LYS . . . . . 0.722 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.881 0.372 . . . . 0.0 110.725 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.932 -179.7 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.76 HG21 ' HB3' ' A' ' 29' ' ' PHE . 10.5 t . . . . . 0 N--CA 1.455 -0.179 0 CA-C-O 120.706 0.289 . . . . 0.0 110.382 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.36 -37.24 77.39 Favored 'General case' 0 N--CA 1.455 -0.225 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 177.201 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -70.72 -35.6 72.8 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.905 177.615 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.735 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 10.9 mtm -64.17 -36.85 85.42 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 177.987 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.66 HD11 ' HB3' ' A' ' 24' ' ' LEU . 1.4 mp -51.69 -52.43 48.31 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.975 179.047 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.45 -33.27 75.33 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.307 178.462 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.51 30.91 4.0 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.908 -178.118 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.451 ' HB1' ' CB ' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.331 -0.235 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.044 179.18 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.531 ' HA ' ' OE1' ' A' ' 19' ' ' GLU . 0.7 OUTLIER . . . . . 0 N--CA 1.453 -0.295 0 CA-C-O 120.668 0.271 . . . . 0.0 110.792 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.407 ' O ' HD12 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -46.73 -66.76 0.36 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.054 -0.521 . . . . 0.0 112.11 -177.568 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.733 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -56.74 -19.17 15.46 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -177.372 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.639 ' N ' ' HD2' ' A' ' 21' ' ' LYS . 1.8 tt0 -72.72 -78.05 0.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.911 0.386 . . . . 0.0 111.294 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' MET . . . . . 0.626 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.47 -97.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.419 -177.074 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.66 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -61.79 -1.04 0.54 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -175.836 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 65.1 -115.84 8.21 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 108.463 -1.855 . . . . 0.0 108.463 -174.079 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.42 ' O ' HD13 ' A' ' 24' ' ' LEU . 0.4 OUTLIER -76.06 -69.54 0.49 Allowed 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 169.447 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.837 ' HG3' HD21 ' A' ' 31' ' ' LEU . 6.3 tpt180 -159.63 12.21 0.13 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 114.309 -1.314 . . . . 0.0 108.107 176.622 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.593 HD12 HD11 ' A' ' 32' ' ' ILE . 3.8 mm? -57.76 -84.14 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.44 -1.255 . . . . 0.0 113.923 -173.412 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.76 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -32.66 -51.53 0.61 Allowed Pre-proline 0 CA--C 1.535 0.392 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -174.977 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.57 ' HG2' ' O ' ' A' ' 27' ' ' ARG . 10.0 Cg_endo -56.03 -41.98 71.32 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.479 2.119 . . . . 0.0 113.787 -177.615 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.837 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.61 -48.81 53.27 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 120.019 -0.672 . . . . 0.0 109.748 -179.427 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.837 HG21 HD12 ' A' ' 43' ' ' ILE . 0.7 OUTLIER -72.17 -13.51 16.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.304 178.578 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.647 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 5.8 tp60 -62.41 -40.01 95.15 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 177.312 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.71 -29.92 70.02 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.227 -0.897 . . . . 0.0 108.882 174.635 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' MET . . . . . 0.471 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 6.8 mtt -101.65 25.61 8.3 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.399 177.986 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.8 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 0.1 OUTLIER -64.07 -32.76 8.09 Favored Pre-proline 0 CA--C 1.536 0.429 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 -177.271 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.8 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 4.0 Cg_exo -36.21 -32.74 0.11 Allowed 'Trans proline' 0 C--N 1.364 1.343 0 C-N-CA 122.498 2.132 . . . . 0.0 112.099 179.33 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' THR . . . . . 1.006 HG21 HG13 ' A' ' 73' ' ' VAL . 0.2 OUTLIER -78.23 -87.23 0.06 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.898 176.83 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.533 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.3 OUTLIER -171.29 59.97 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.371 178.388 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.503 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -48.64 -31.36 6.6 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 120.894 0.378 . . . . 0.0 111.309 179.475 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.647 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -44.43 -63.99 2.21 Favored Glycine 0 N--CA 1.453 -0.225 0 CA-C-N 115.684 -0.689 . . . . 0.0 114.372 -178.505 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.563 ' HE3' ' HG3' ' B' ' 12' ' ' GLU . 0.0 OUTLIER -77.79 -29.61 50.93 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -176.999 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.918 HD11 HD11 ' A' ' 76' ' ' LEU . 15.9 mt -53.88 -53.92 23.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.467 -178.622 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.555 HG21 ' CD2' ' A' ' 29' ' ' PHE . 6.7 t -47.14 -46.6 23.36 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.143 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.64 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -53.44 -61.06 7.37 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.917 -0.583 . . . . 0.0 113.022 179.304 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.575 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.45 -52.6 63.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.665 0.269 . . . . 0.0 111.492 -178.516 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.582 HD11 ' HB3' ' B' ' 6' ' ' LEU . 3.0 mm? -80.04 5.72 13.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.685 -178.327 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.474 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.0 -16.58 64.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.837 0.351 . . . . 0.0 110.717 179.57 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' B' ' 9' ' ' ASN . 3.4 mm-40 -76.65 18.84 0.3 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.807 179.513 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.43 ' H ' ' C ' ' A' ' 48' ' ' LEU . 0.4 OUTLIER -83.23 161.3 3.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.528 179.89 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.55 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 6.3 m-20 -70.49 155.51 40.61 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.98 0.419 . . . . 0.0 111.51 -178.394 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.887 ' HA ' HD23 ' A' ' 55' ' ' LEU . 5.1 m120 -83.33 -30.95 27.08 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.323 178.544 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.2 t -74.04 -33.7 63.82 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.302 0.572 . . . . 0.0 109.521 177.678 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.55 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -77.96 -24.93 47.95 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.552 179.445 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.887 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -60.28 -48.11 83.15 Favored 'General case' 0 C--O 1.231 0.121 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 178.461 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.431 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 2.0 tm? -58.71 -39.88 82.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.094 178.679 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.49 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 12.9 t-80 -60.19 -40.21 89.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.543 178.707 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.563 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -62.21 -41.65 98.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.073 0.463 . . . . 0.0 110.309 178.815 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.649 HD12 ' CZ ' ' A' ' 27' ' ' ARG . 8.1 tt -67.19 -19.51 65.58 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.7 178.939 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 57' ' ' HIS . 5.2 pt-20 -105.03 -6.6 19.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.52 -178.935 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.564 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.3 OUTLIER -123.0 86.79 50.94 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.139 -179.69 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.467 ' O ' ' HB2' ' A' ' 66' ' ' ARG . 23.9 Cg_endo -61.3 -30.13 87.3 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.18 1.92 . . . . 0.0 111.863 179.038 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -78.09 -51.13 10.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.436 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.415 ' O ' ' HB2' ' A' ' 67' ' ' SER . 66.9 m -69.83 -50.43 42.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.633 -178.307 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.827 HD21 HD13 ' A' ' 31' ' ' LEU . 0.0 OUTLIER -58.03 -59.77 4.75 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.282 -178.626 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.63 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -51.78 -30.27 22.31 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.618 -178.635 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.57 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 2.5 m -67.36 -37.71 83.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.314 178.356 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.459 ' HE3' ' OE2' ' A' ' 54' ' ' GLU . 3.2 mtmm -65.72 -59.33 4.02 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.164 178.516 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.567 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 74.9 t -62.75 -18.71 21.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.58 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.57 ' HB3' ' O ' ' A' ' 67' ' ' SER . 7.3 t70 -56.92 -48.82 77.35 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 176.2 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.41 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 43.8 tt0 -67.87 -29.31 68.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.628 176.24 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.805 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -59.27 -42.74 91.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.341 178.45 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 1.006 HG13 HG21 ' A' ' 38' ' ' THR . 14.6 t -60.73 -30.52 47.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 176.846 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -73.52 -31.88 63.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.056 178.694 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.73 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.1 m -61.0 -30.02 46.81 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.084 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 179.234 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.918 HD11 HD11 ' A' ' 43' ' ' ILE . 76.2 mt -65.94 -56.67 10.54 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 121.233 0.54 . . . . 0.0 109.942 177.227 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 21.2 mm100 -51.02 -36.11 37.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.026 -0.988 . . . . 0.0 110.591 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.81 -27.54 33.6 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.042 178.194 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 0.595 ' HB2' ' O ' ' A' ' 75' ' ' VAL . 0.9 OUTLIER . . . . . 0 C--N 1.331 -0.218 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.196 -179.337 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.726 0.298 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.582 ' HB3' HD11 ' A' ' 47' ' ' LEU . 9.7 tp -62.82 -81.36 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.769 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 7' ' ' ASN . . . . . 0.446 ' HB2' ' CD1' ' A' ' 47' ' ' LEU . 1.7 t-20 -78.75 130.03 71.92 Favored Pre-proline 0 C--N 1.332 -0.194 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.706 178.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.93 1.38 8.95 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.107 1.871 . . . . 0.0 112.108 179.369 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 9' ' ' ASN . . . . . 0.477 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 13.3 m120 -123.52 46.71 2.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.918 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 10' ' ' ALA . . . . . 0.575 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.27 95.82 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.573 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.425 ' HG3' ' O ' ' B' ' 9' ' ' ASN . 1.0 OUTLIER -121.49 170.46 9.64 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.502 178.949 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 12' ' ' GLU . . . . . 0.563 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 2.3 tt0 -68.06 163.8 21.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.795 0.331 . . . . 0.0 111.03 179.738 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 13' ' ' PHE . . . . . 0.64 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.2 t80 . . . . . 0 C--N 1.332 -0.185 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.152 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 18' ' ' LYS . . . . . 0.733 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.064 0 CA-C-O 120.929 0.395 . . . . 0.0 110.954 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 2.4 t80 . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.004 -179.912 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.796 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 10.8 t . . . . . 0 N--CA 1.456 -0.157 0 CA-C-O 120.727 0.299 . . . . 0.0 110.521 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.517 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.46 -38.26 80.31 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 176.857 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 10.7 t -71.13 -34.35 70.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.608 177.184 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.796 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 5.3 mtm -64.36 -33.92 76.96 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 177.139 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.759 HD12 ' SD ' ' A' ' 23' ' ' MET . 3.7 mp -52.79 -54.66 30.89 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.891 178.421 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.32 -25.92 67.06 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.242 178.8 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.1 m -101.66 14.02 33.2 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.963 -178.158 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.632 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.33 -0.279 0 CA-C-O 120.515 0.198 . . . . 0.0 111.281 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.632 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.774 0.321 . . . . 0.0 110.92 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.486 ' O ' HD12 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -60.87 -49.44 77.48 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.354 179.626 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.566 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -56.88 -21.74 31.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.255 -179.82 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.566 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 12.5 tp60 -73.84 -80.49 0.07 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.035 0.445 . . . . 0.0 111.641 179.562 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' MET . . . . . 0.759 ' SD ' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -70.05 -94.87 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -176.032 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.605 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -58.91 0.96 0.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -174.993 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.411 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . 64.83 -117.13 9.87 Favored Glycine 0 N--CA 1.444 -0.791 0 N-CA-C 108.342 -1.903 . . . . 0.0 108.342 -174.488 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' A' ' 51' ' ' ASP . 2.2 mp0 -76.06 -69.12 0.52 Allowed 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 169.083 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.846 ' HB2' HD13 ' A' ' 55' ' ' LEU . 1.7 tpt180 -159.99 9.27 0.1 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.259 -1.337 . . . . 0.0 107.939 175.065 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.969 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.59 -69.78 0.19 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 114.308 -1.315 . . . . 0.0 113.561 -173.61 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.588 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -37.93 -49.0 3.02 Favored Pre-proline 0 CA--C 1.538 0.503 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -175.847 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.599 ' HG2' ' HD2' ' A' ' 27' ' ' ARG . 46.5 Cg_exo -58.97 -43.89 39.52 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 122.37 2.046 . . . . 0.0 113.505 -178.677 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.609 HD13 ' CD1' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.89 -46.02 63.32 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.216 -178.313 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.852 HD11 HD23 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -74.96 -12.61 15.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.166 178.087 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.636 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -62.09 -39.77 93.57 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 176.557 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.46 -31.77 72.16 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.058 174.894 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' MET . . . . . 0.518 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 6.4 mtt -100.23 27.42 5.66 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.394 178.185 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.636 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 2.0 p-80 -65.31 -31.99 5.8 Favored Pre-proline 0 CA--C 1.536 0.431 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 -177.383 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.581 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 47.5 Cg_exo -35.78 -32.53 0.1 OUTLIER 'Trans proline' 0 C--N 1.361 1.209 0 C-N-CA 122.278 1.985 . . . . 0.0 112.597 179.709 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.405 ' HB ' ' H ' ' A' ' 39' ' ' LEU . 16.9 m -78.28 -83.27 0.09 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.131 177.144 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.516 HD12 ' HB2' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -171.09 52.77 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.201 178.828 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.485 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -38.33 -42.54 0.72 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.97 -179.408 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.588 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -52.73 -49.44 53.62 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 121.046 -0.597 . . . . 0.0 113.641 -178.706 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.953 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.1 OUTLIER -77.05 -36.7 55.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 117.061 0.431 . . . . 0.0 111.616 -178.491 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.72 HD12 HG21 ' A' ' 32' ' ' ILE . 0.4 OUTLIER -53.63 -62.62 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.724 0.297 . . . . 0.0 110.721 -179.846 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.969 ' HA ' HD22 ' A' ' 28' ' ' LEU . 8.9 t -48.56 -44.11 36.26 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.261 178.622 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.881 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -48.12 -67.79 1.47 Allowed Glycine 0 C--O 1.227 -0.289 0 CA-C-N 115.655 -0.702 . . . . 0.0 113.201 179.851 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.501 ' HA ' ' C ' ' B' ' 11' ' ' LYS . 0.0 OUTLIER -54.68 -56.83 14.97 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.797 0.295 . . . . 0.0 111.797 -178.057 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.861 HD23 ' HB2' ' B' ' 7' ' ' ASN . 2.8 mp -79.99 17.42 0.98 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 -177.683 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.639 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.72 -18.09 65.19 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.121 0.486 . . . . 0.0 109.871 177.044 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.601 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.1 mt-10 -74.65 19.96 0.13 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.335 179.513 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.435 ' H ' ' C ' ' A' ' 48' ' ' LEU . 1.8 tt -83.29 162.74 3.11 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-O 120.828 0.347 . . . . 0.0 110.959 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.487 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 1.1 m-20 -71.18 154.73 41.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.102 -0.499 . . . . 0.0 112.288 -178.298 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.766 ' HA ' HD23 ' A' ' 55' ' ' LEU . 3.7 m-80 -82.54 -27.39 31.68 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.551 176.192 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -74.19 -32.91 63.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.805 177.585 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.4 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 4.5 mt-10 -75.71 -28.7 58.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.419 178.842 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.846 HD13 ' HB2' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -59.84 -46.94 87.7 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.149 179.288 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.406 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -57.57 -48.6 78.89 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.505 179.255 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.405 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 0.3 OUTLIER -57.26 -40.12 77.01 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.865 179.776 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.565 ' SD ' ' HE2' ' A' ' 68' ' ' LYS . 12.9 mmt -64.41 -41.55 96.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.01 0.434 . . . . 0.0 110.294 179.104 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.454 HD12 ' NE ' ' A' ' 27' ' ' ARG . 4.9 tt -69.39 -14.99 63.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.78 179.712 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.405 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 0.0 OUTLIER -106.58 -9.12 16.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.35 -179.751 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.649 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -123.22 85.65 51.59 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.934 -179.678 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_endo -61.34 -33.1 89.76 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.295 1.997 . . . . 0.0 112.173 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.32 -46.36 20.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.463 -179.429 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 30.8 m -70.22 -48.39 57.26 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.859 0.361 . . . . 0.0 111.316 -178.629 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.65 ' HG ' ' N ' ' A' ' 66' ' ' ARG . 0.1 OUTLIER -58.01 -58.57 7.82 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.749 -178.937 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.65 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -50.9 -34.07 26.87 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.241 -177.625 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.54 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 35.3 t -63.41 -41.95 98.75 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.118 0.485 . . . . 0.0 110.153 178.246 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.565 ' HE2' ' SD ' ' A' ' 58' ' ' MET . 1.0 OUTLIER -66.21 -57.32 7.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.686 179.285 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.553 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 71.1 t -63.36 -19.08 23.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.775 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.638 ' O ' HG22 ' A' ' 73' ' ' VAL . 7.5 t70 -56.97 -48.85 77.42 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 176.539 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.518 ' HB3' HD12 ' B' ' 6' ' ' LEU . 0.8 OUTLIER -68.87 -25.54 64.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.843 176.56 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.688 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -61.18 -48.78 79.99 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.845 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.658 ' HA ' HD13 ' A' ' 43' ' ' ILE . 2.6 m -58.68 -30.14 41.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 177.334 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.51 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -69.08 -37.98 78.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.287 -0.869 . . . . 0.0 111.196 179.331 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.549 HG22 ' O ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -57.31 -29.02 31.8 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 178.664 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.953 HD11 ' HB3' ' A' ' 42' ' ' LYS . 3.9 mm? -72.0 -50.7 26.47 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.073 177.081 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 67.6 mm-40 -51.38 -31.25 21.73 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.241 -0.891 . . . . 0.0 109.697 178.294 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.47 -30.09 33.51 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.581 177.565 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 2.7 t-160 . . . . . 0 C--N 1.333 -0.12 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.636 179.332 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 4.1 m120 . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.74 0.305 . . . . 0.0 110.997 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.518 HD12 ' HB3' ' A' ' 71' ' ' GLU . 0.8 OUTLIER -80.62 -81.43 0.13 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.84 -179.982 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 7' ' ' ASN . . . . . 0.861 ' HB2' HD23 ' A' ' 47' ' ' LEU . 0.8 OUTLIER -81.47 122.82 81.22 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.757 179.452 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -78.54 9.88 3.02 Favored 'Trans proline' 0 N--CA 1.459 -0.517 0 C-N-CA 122.16 1.906 . . . . 0.0 112.034 179.252 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 9' ' ' ASN . . . . . 0.519 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 56.5 m-20 -123.25 34.33 5.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.034 -179.784 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.77 90.01 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.654 -179.57 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.601 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 1.9 mttm -129.1 138.56 51.91 Favored 'General case' 0 C--O 1.226 -0.179 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.132 178.625 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -46.58 163.04 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -177.187 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 13' ' ' PHE . . . . . 0.881 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.7 OUTLIER . . . . . 0 N--CA 1.463 0.187 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.786 179.433 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 5.0 mttm . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.906 0.384 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.466 ' HD1' ' HA ' ' B' ' 19' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.83 -179.679 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.794 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 8.2 t . . . . . 0 CA--C 1.521 -0.141 0 CA-C-O 120.704 0.288 . . . . 0.0 110.372 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.452 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.43 -39.24 82.87 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 176.418 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 39.3 t -68.94 -33.1 73.17 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.454 176.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.794 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.2 mtm -64.13 -34.86 79.01 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.818 177.776 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.502 HD11 ' HB3' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -55.25 -49.96 70.69 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.329 178.684 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.05 -32.41 73.86 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.611 178.629 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.1 m -101.38 46.67 0.93 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.76 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.845 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 CA--C 1.537 0.447 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 -178.027 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.845 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 2.1 tp10 . . . . . 0 N--CA 1.455 -0.203 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.464 ' HA ' HD11 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -46.25 -56.31 5.95 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.672 -177.512 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.519 ' HG3' ' H ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -56.02 -24.3 38.37 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.506 -178.342 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.475 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 17.1 tp60 -73.6 -78.45 0.09 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.908 0.385 . . . . 0.0 111.838 179.398 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' MET . . . . . 0.587 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -68.96 -97.29 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 112.997 0.74 . . . . 0.0 112.997 -175.93 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.587 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -57.03 0.34 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.275 0 N-CA-C 113.51 0.929 . . . . 0.0 113.51 -175.519 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.419 ' H ' ' C ' ' A' ' 23' ' ' MET . . . 64.79 -117.19 9.99 Favored Glycine 0 CA--C 1.505 -0.594 0 N-CA-C 108.269 -1.932 . . . . 0.0 108.269 -174.685 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.535 ' HG2' HG22 ' A' ' 50' ' ' ILE . 0.4 OUTLIER -75.56 -68.27 0.58 Allowed 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 168.089 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.832 ' HE ' HD13 ' A' ' 59' ' ' LEU . 1.1 tpt180 -160.52 8.42 0.09 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.151 -1.386 . . . . 0.0 107.999 174.37 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.955 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.23 -73.96 0.08 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.551 -1.204 . . . . 0.0 113.896 -172.921 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.578 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.2 OUTLIER -36.79 -49.79 1.99 Allowed Pre-proline 0 CA--C 1.536 0.431 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -175.336 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.602 ' HG2' ' O ' ' A' ' 27' ' ' ARG . 12.4 Cg_endo -58.95 -41.69 59.41 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 121.975 1.783 . . . . 0.0 113.128 -178.053 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.637 HD13 ' CD1' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -71.06 -45.44 63.79 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 120.339 -0.545 . . . . 0.0 110.182 -179.663 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.642 HD11 HD23 ' A' ' 28' ' ' LEU . 0.8 OUTLIER -71.56 -17.27 19.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.313 -0.403 . . . . 0.0 109.933 177.59 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.643 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 2.0 tt0 -63.26 -32.51 73.93 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 176.455 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.5 -29.64 65.04 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.679 -0.859 . . . . 0.0 108.679 175.02 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' MET . . . . . 0.427 ' HE1' ' HB ' ' A' ' 69' ' ' VAL . 8.9 mtt -100.08 19.67 15.91 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 114.84 -1.073 . . . . 0.0 109.72 177.242 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.643 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.6 OUTLIER -63.81 -34.8 13.25 Favored Pre-proline 0 CA--C 1.532 0.263 0 CA-C-N 115.511 -0.768 . . . . 0.0 112.106 -178.636 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.542 ' CD ' ' N ' ' A' ' 36' ' ' HIS . 87.4 Cg_exo -42.18 -26.22 0.5 Allowed 'Trans proline' 0 C--N 1.361 1.191 0 C-N-CA 121.769 1.646 . . . . 0.0 111.066 177.323 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' THR . . . . . 1.081 HG21 HG13 ' A' ' 73' ' ' VAL . 86.8 m -77.99 -80.95 0.1 Allowed 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.325 -0.852 . . . . 0.0 109.556 176.089 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.612 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -171.63 52.51 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 112.608 0.595 . . . . 0.0 112.608 178.61 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -56.86 149.51 18.33 Favored 'General case' 0 C--O 1.231 0.127 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 176.681 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.578 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . 132.57 -73.41 0.46 Allowed Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.566 -178.364 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.56 -28.17 51.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.698 0.285 . . . . 0.0 111.043 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.627 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 55.2 mt -54.05 -53.77 25.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.795 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.955 ' HA ' HD22 ' A' ' 28' ' ' LEU . 13.1 t -54.25 -37.02 64.21 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.827 0.346 . . . . 0.0 110.538 178.972 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.857 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -48.12 -70.5 0.73 Allowed Glycine 0 N--CA 1.45 -0.418 0 CA-C-N 115.745 -0.661 . . . . 0.0 113.119 -179.573 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.473 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.36 -45.67 76.48 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -178.127 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.47 HD11 ' HB3' ' B' ' 6' ' ' LEU . 3.1 mm? -79.91 7.7 8.36 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -177.805 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.616 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.34 -7.38 18.6 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.881 0.372 . . . . 0.0 110.853 179.556 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.41 ' OE1' ' HG3' ' B' ' 11' ' ' LYS . 1.2 mm-40 -85.65 18.55 2.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.807 179.187 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.535 HG22 ' HG2' ' A' ' 26' ' ' GLU . 0.8 OUTLIER -83.72 162.63 3.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.861 -179.684 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.51 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 21.3 m-20 -70.96 157.58 37.95 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.902 0.382 . . . . 0.0 111.778 -178.506 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.928 ' HA ' HD23 ' A' ' 55' ' ' LEU . 7.7 m-80 -87.07 -29.87 21.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.91 -0.587 . . . . 0.0 109.971 177.72 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.1 -30.51 62.37 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 177.094 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.51 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -78.38 -27.41 46.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.59 179.058 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.928 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.8 OUTLIER -61.6 -47.07 87.14 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.473 179.98 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 58.1 tp -61.9 -43.85 98.01 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.946 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -60.2 -28.48 68.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.443 -179.644 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.55 ' HB3' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -68.39 -51.07 48.13 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.529 -179.076 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.832 HD13 ' HE ' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -63.58 -20.24 65.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.194 -179.303 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -95.53 -5.84 41.84 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.02 0.438 . . . . 0.0 110.496 178.712 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.631 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 5.1 m -122.69 79.46 48.27 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.631 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -55.29 -34.57 88.95 Favored 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 122.36 2.04 . . . . 0.0 112.178 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -78.41 -49.34 13.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.945 -179.36 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.534 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 15.7 m -69.2 -45.96 68.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.961 0.41 . . . . 0.0 111.39 -178.029 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.637 ' CD1' HD13 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -59.46 -61.49 2.59 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.774 -178.558 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.627 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -50.78 -31.76 17.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.208 -177.538 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.531 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 20.7 t -63.86 -42.76 97.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.11 0.481 . . . . 0.0 110.276 178.346 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.404 ' HG2' HD21 ' B' ' 6' ' ' LEU . 6.3 ttmm -66.31 -58.12 6.01 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.853 179.472 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.478 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 79.3 t -62.37 -20.78 25.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.616 179.664 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.531 ' HB3' ' O ' ' A' ' 67' ' ' SER . 9.6 t0 -54.71 -49.08 71.59 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 176.343 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.507 ' HG2' ' HB3' ' B' ' 5' ' ' ASN . 0.5 OUTLIER -68.88 -29.48 67.79 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.847 176.495 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.627 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -60.44 -38.01 82.74 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.087 178.068 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 1.081 HG13 HG21 ' A' ' 38' ' ' THR . 3.6 t -64.74 -29.35 47.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 176.781 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.446 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -73.15 -38.94 66.06 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.251 179.375 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.568 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.07 -30.34 38.79 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-O 121.127 0.489 . . . . 0.0 110.086 179.343 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.612 ' HG ' ' HB3' ' A' ' 39' ' ' LEU . 3.0 tm? -71.19 -52.78 17.18 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.209 178.689 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -55.99 -34.52 65.85 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.614 179.646 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.01 -23.04 38.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.787 179.045 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 0.428 ' HB2' ' O ' ' A' ' 75' ' ' VAL . 19.3 t60 . . . . . 0 C--N 1.331 -0.229 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.86 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 5' ' ' ASN . . . . . 0.507 ' HB3' ' HG2' ' A' ' 71' ' ' GLU . 1.8 m-80 . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.753 0.311 . . . . 0.0 110.923 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.47 ' HB3' HD11 ' A' ' 47' ' ' LEU . 0.2 OUTLIER -71.27 -84.52 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.685 179.806 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -78.41 139.11 59.38 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.851 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -79.01 -9.21 15.5 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 122.328 2.018 . . . . 0.0 111.94 178.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 72.7 m-80 -123.31 57.79 1.14 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.79 179.79 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 10' ' ' ALA . . . . . 0.473 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -59.76 93.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.603 -179.613 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.41 ' HG3' ' OE1' ' A' ' 49' ' ' GLU . 10.2 mttp -114.02 125.19 53.71 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.337 179.038 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -48.74 168.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -177.797 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 13' ' ' PHE . . . . . 0.857 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.142 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.07 179.159 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.939 0.4 . . . . 0.0 110.674 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.008 -179.427 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.774 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 10.2 t . . . . . 0 CA--C 1.521 -0.135 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.466 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.48 -37.48 78.35 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 176.766 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.2 t -68.0 -34.73 77.08 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.739 177.307 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.774 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 12.0 mtm -64.21 -36.49 84.25 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.912 177.577 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.692 ' HA ' ' HE2' ' A' ' 23' ' ' MET . 4.1 mp -52.15 -48.68 64.77 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.117 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.03 -30.89 71.5 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.022 178.583 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.5 p -101.37 19.5 17.66 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.54 -178.796 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.579 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.21 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.579 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.9 OUTLIER . . . . . 0 N--CA 1.457 -0.114 0 CA-C-O 120.807 0.337 . . . . 0.0 110.83 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.477 ' O ' HD12 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -52.18 -57.61 9.11 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.372 -179.77 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.538 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.9 -20.37 15.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.539 -178.608 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.568 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 5.0 tp60 -73.2 -79.46 0.08 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.873 0.368 . . . . 0.0 111.341 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' MET . . . . . 0.692 ' HE2' ' HA ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.87 -94.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -176.682 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.59 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -60.88 1.94 0.13 Allowed 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 113.682 0.993 . . . . 0.0 113.682 -174.876 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.86 -117.01 9.63 Favored Glycine 0 N--CA 1.445 -0.759 0 N-CA-C 108.359 -1.896 . . . . 0.0 108.359 -174.381 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.565 ' HG2' HG22 ' A' ' 50' ' ' ILE . 0.3 OUTLIER -75.49 -68.51 0.56 Allowed 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 107.24 -1.392 . . . . 0.0 107.24 168.572 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.872 ' HG2' HD12 ' A' ' 59' ' ' LEU . 3.6 tpt85 -160.34 9.37 0.1 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.303 -1.317 . . . . 0.0 108.223 174.643 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.966 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.3 OUTLIER -58.73 -72.89 0.09 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 114.407 -1.27 . . . . 0.0 113.893 -173.244 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.647 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -36.01 -49.0 1.57 Allowed Pre-proline 0 CA--C 1.539 0.546 0 N-CA-C 113.318 0.858 . . . . 0.0 113.318 -175.454 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.538 ' O ' ' HB3' ' A' ' 33' ' ' GLN . 51.4 Cg_exo -59.39 -42.12 51.86 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.39 2.06 . . . . 0.0 113.573 -178.72 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.847 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.52 -46.84 62.87 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 120.458 -0.497 . . . . 0.0 109.987 -178.627 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.614 HD11 HD23 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -74.57 -12.95 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.589 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.056 177.913 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.667 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 1.1 tt0 -62.46 -39.19 92.58 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 176.904 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.85 -30.5 69.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.432 -0.804 . . . . 0.0 108.881 174.832 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' MET . . . . . 0.53 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 7.4 mtt -100.3 26.0 7.02 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.254 177.911 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.667 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.7 p-80 -64.98 -32.22 6.37 Favored Pre-proline 0 CA--C 1.536 0.418 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -177.939 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.614 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 42.8 Cg_exo -33.65 -35.47 0.08 OUTLIER 'Trans proline' 0 C--N 1.365 1.405 0 C-N-CA 122.288 1.992 . . . . 0.0 112.133 179.212 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.486 ' HB ' ' H ' ' A' ' 39' ' ' LEU . 2.7 m -78.1 -88.87 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.458 175.877 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.531 ' HB3' ' CD1' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -171.79 66.6 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.723 -0.217 . . . . 0.0 111.399 177.668 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.521 ' HB1' ' HB ' ' A' ' 32' ' ' ILE . . . -48.13 -32.67 7.21 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.565 179.561 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.647 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -46.41 -60.26 4.8 Favored Glycine 0 CA--C 1.518 0.256 0 CA-C-N 115.988 -0.551 . . . . 0.0 114.384 -178.283 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.858 ' HE3' ' HG3' ' B' ' 12' ' ' GLU . 4.4 tptm -77.27 -33.23 55.91 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.938 0.369 . . . . 0.0 111.943 -177.364 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.602 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 29.9 mt -54.01 -57.67 5.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.739 -0.21 . . . . 0.0 111.062 -179.212 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.966 ' HA ' HD22 ' A' ' 28' ' ' LEU . 9.3 t -50.16 -42.61 51.31 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.889 0.376 . . . . 0.0 110.244 178.58 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.89 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -49.35 -67.13 1.88 Allowed Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.681 -0.691 . . . . 0.0 113.296 -179.822 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.724 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.4 -47.26 76.16 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.74 0.27 . . . . 0.0 111.488 -178.157 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.445 ' O ' ' HB ' ' A' ' 50' ' ' ILE . 3.0 mm? -79.87 6.07 12.1 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -178.538 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.594 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.94 -10.58 40.3 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.915 0.388 . . . . 0.0 110.507 179.836 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.447 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 1.6 mm-40 -82.37 21.36 0.95 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.232 177.458 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.613 HD11 ' HE3' ' A' ' 68' ' ' LYS . 0.4 OUTLIER -83.53 160.73 3.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.991 -179.377 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.481 ' HB2' ' HG3' ' A' ' 54' ' ' GLU . 0.9 OUTLIER -70.87 156.61 39.36 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.658 -178.835 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.922 ' HA ' HD23 ' A' ' 55' ' ' LEU . 14.4 m-80 -85.85 -27.87 24.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.197 178.037 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.82 -34.32 64.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.153 0.501 . . . . 0.0 109.769 177.672 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.539 ' O ' ' HG2' ' A' ' 58' ' ' MET . 4.5 mt-10 -76.43 -29.22 56.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.79 179.187 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.922 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -58.98 -45.92 89.39 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.959 0.409 . . . . 0.0 109.961 179.495 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.548 ' HA ' HD11 ' A' ' 59' ' ' LEU . 0.4 OUTLIER -60.25 -44.35 95.34 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.668 179.453 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -64.96 -13.68 58.05 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.057 179.626 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.687 ' SD ' ' HE2' ' A' ' 68' ' ' LYS . 31.7 mmt -76.29 -56.91 4.21 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.466 -179.691 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.872 HD12 ' HG2' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -67.1 -8.57 31.69 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 121.105 0.479 . . . . 0.0 110.429 178.927 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.541 ' N ' HD22 ' A' ' 59' ' ' LEU . 1.1 tp10 -98.61 -16.42 19.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.502 179.188 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.511 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 1.2 t -122.71 87.97 49.94 Favored Pre-proline 0 C--N 1.332 -0.153 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.373 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -60.22 -31.57 93.24 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.345 2.03 . . . . 0.0 111.89 179.052 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.462 ' O ' ' HB2' ' A' ' 67' ' ' SER . 6.9 mm-40 -77.87 -50.34 12.45 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.475 -179.693 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 67.8 m -69.38 -53.31 20.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.444 -178.558 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.847 HD21 HD13 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -57.99 -62.56 1.72 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.645 -178.177 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.679 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -49.93 -35.68 24.83 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.022 -177.639 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.506 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.2 OUTLIER -69.59 -36.14 75.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.159 0.504 . . . . 0.0 110.048 178.046 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.813 ' HG2' HD21 ' B' ' 6' ' ' LEU . 0.1 OUTLIER -66.4 -53.88 30.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.659 179.248 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.559 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 40.0 t -68.05 -19.08 24.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.317 178.537 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.694 ' O ' HG22 ' A' ' 73' ' ' VAL . 19.4 t0 -55.68 -48.75 74.54 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 176.596 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.522 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 1.2 tp10 -69.05 -26.34 64.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.739 176.53 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.602 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -60.78 -47.94 84.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.924 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.694 HG22 ' O ' ' A' ' 70' ' ' ASP . 4.9 m -60.2 -28.33 41.41 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.156 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 177.108 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.522 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -71.43 -30.26 65.85 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.133 178.921 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.599 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -69.12 -36.16 71.99 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 CA-C-O 120.812 0.339 . . . . 0.0 110.476 179.592 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.646 HD12 ' HB3' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -71.73 -56.32 6.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.939 179.782 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.458 ' NE2' ' HB2' ' A' ' 78' ' ' ALA . 4.6 pp0? -52.41 -36.66 54.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.134 0.492 . . . . 0.0 110.332 179.794 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.458 ' HB2' ' NE2' ' A' ' 77' ' ' GLN . . . -80.8 -24.38 38.58 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.756 178.453 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 0.431 ' HB2' ' O ' ' A' ' 75' ' ' VAL . 77.2 t60 . . . . . 0 C--N 1.332 -0.185 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.727 179.605 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 20.9 m120 . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.716 0.294 . . . . 0.0 111.32 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.813 HD21 ' HG2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -62.57 -73.34 0.11 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.006 -179.394 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -90.5 128.78 47.48 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.186 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -77.79 -1.07 11.25 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.259 1.972 . . . . 0.0 111.798 178.501 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 9' ' ' ASN . . . . . 0.582 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 26.6 m120 -123.41 52.12 1.43 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.682 179.749 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 10' ' ' ALA . . . . . 0.724 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.41 98.25 0.06 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.892 -179.553 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.582 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 2.7 mmtm -121.97 141.32 51.44 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.54 178.344 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 12' ' ' GLU . . . . . 0.858 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 17.2 mp0 -50.24 162.4 0.22 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.948 0.404 . . . . 0.0 111.999 -179.058 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 13' ' ' PHE . . . . . 0.89 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.9 OUTLIER . . . . . 0 CA--C 1.52 -0.206 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.614 177.809 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.902 0.382 . . . . 0.0 110.808 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.36 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.983 -179.494 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.767 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 8.9 t . . . . . 0 CA--C 1.521 -0.138 0 CA-C-O 120.614 0.245 . . . . 0.0 110.503 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.406 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.32 -39.4 82.97 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 176.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 10.9 t -69.69 -33.63 72.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.763 177.224 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.767 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.4 mtm -64.29 -37.04 86.08 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 116.169 -0.469 . . . . 0.0 109.888 177.726 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.761 HD11 ' HB3' ' A' ' 24' ' ' LEU . 1.4 mp -52.0 -51.83 54.66 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.205 179.125 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.22 -31.92 73.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.441 178.917 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.57 23.61 10.93 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.343 -0.39 . . . . 0.0 112.002 -178.137 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.601 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.329 -0.305 0 CA-C-O 120.555 0.217 . . . . 0.0 111.285 179.582 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.69 ' HG3' ' HB3' ' A' ' 22' ' ' GLN . 5.8 tp10 . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.683 0.278 . . . . 0.0 111.074 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.405 ' O ' HD23 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -52.05 -58.36 6.76 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.387 -179.908 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.576 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.93 -21.81 22.67 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.543 -178.242 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.69 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 20.8 tp60 -73.39 -80.27 0.07 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.992 0.425 . . . . 0.0 111.654 179.683 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' MET . . . . . 0.626 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.62 -94.94 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -176.7 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.761 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -59.96 -1.34 0.28 Allowed 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 -174.819 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.577 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 65.06 -116.93 9.47 Favored Glycine 0 N--CA 1.446 -0.648 0 N-CA-C 108.501 -1.84 . . . . 0.0 108.501 -174.54 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.465 ' HB3' ' HB2' ' A' ' 55' ' ' LEU . 0.7 OUTLIER -76.2 -67.23 0.7 Allowed 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 169.592 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.849 ' HG3' HD21 ' A' ' 31' ' ' LEU . 6.5 tpt180 -159.65 7.06 0.1 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.247 -1.342 . . . . 0.0 108.06 175.878 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.92 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.3 OUTLIER -59.19 -78.06 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.441 -1.254 . . . . 0.0 114.26 -172.906 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.615 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -32.88 -48.84 0.58 Allowed Pre-proline 0 CA--C 1.541 0.601 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -175.099 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.592 ' CD ' ' HB2' ' A' ' 24' ' ' LEU . 20.1 Cg_endo -63.44 -39.33 37.31 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.336 2.024 . . . . 0.0 113.817 -178.107 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 1.001 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.44 -45.48 65.72 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 119.997 -0.681 . . . . 0.0 109.506 179.981 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.511 HD11 HD23 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -73.46 -13.29 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.688 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.698 177.46 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.652 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 3.7 tp60 -62.52 -38.1 88.63 Favored 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 177.213 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.41 -28.98 65.49 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 174.673 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' MET . . . . . 0.57 ' HE2' HH11 ' A' ' 66' ' ' ARG . 7.8 mtt -100.16 25.61 7.32 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.087 177.858 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.652 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -64.62 -31.49 5.75 Favored Pre-proline 0 CA--C 1.536 0.422 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 -177.471 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.611 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 35.7 Cg_exo -33.31 -34.98 0.07 OUTLIER 'Trans proline' 0 C--N 1.364 1.352 0 C-N-CA 122.339 2.026 . . . . 0.0 112.034 178.709 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.492 ' HB ' ' H ' ' A' ' 39' ' ' LEU . 0.2 OUTLIER -78.01 -90.99 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 175.383 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.492 ' H ' ' HB ' ' A' ' 38' ' ' THR . 0.1 OUTLIER -171.88 67.07 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.649 -0.251 . . . . 0.0 111.307 177.163 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.536 ' HA ' HD12 ' A' ' 43' ' ' ILE . . . -46.38 -28.74 1.43 Allowed 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.922 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.615 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -50.45 -62.08 5.43 Favored Glycine 0 CA--C 1.518 0.27 0 CA-C-N 116.172 -0.467 . . . . 0.0 113.941 -178.375 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.558 ' HE3' ' HG3' ' B' ' 12' ' ' GLU . 4.6 tptm -74.95 -33.71 61.96 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.021 0.378 . . . . 0.0 112.021 -177.299 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.655 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 30.5 mt -54.36 -57.37 6.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.432 -178.711 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.92 ' HA ' HD22 ' A' ' 28' ' ' LEU . 9.0 t -51.2 -45.52 61.88 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.898 0.38 . . . . 0.0 110.519 178.985 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.624 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -49.66 -64.8 3.2 Favored Glycine 0 N--CA 1.451 -0.311 0 CA-C-N 115.689 -0.687 . . . . 0.0 113.282 -179.452 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.541 ' HB2' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.64 -47.57 76.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.83 0.315 . . . . 0.0 111.79 -178.374 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.418 HD22 ' HG3' ' A' ' 46' ' ' MET . 3.5 mm? -80.18 6.58 11.35 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.649 0.24 . . . . 0.0 111.649 -178.733 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.624 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.17 -7.01 15.4 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.989 0.423 . . . . 0.0 110.77 179.897 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.434 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 3.2 mt-10 -81.67 16.85 1.61 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.295 177.779 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -83.1 160.78 3.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.112 -179.187 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.464 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 1.5 m-20 -71.11 158.17 36.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.805 -178.765 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.821 ' HA ' HD23 ' A' ' 55' ' ' LEU . 12.2 m-80 -86.69 -28.97 22.8 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.841 177.431 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.75 -32.62 63.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.37 0.605 . . . . 0.0 109.519 177.08 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.464 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -75.7 -28.59 58.66 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.564 179.168 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.821 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -60.52 -47.22 87.12 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.002 0.429 . . . . 0.0 110.348 179.533 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.451 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 52.1 tp -58.1 -43.69 87.23 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.555 179.603 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.475 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 1.7 t-80 -59.37 -41.29 88.98 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.67 179.122 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.543 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -61.21 -38.68 87.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.353 178.933 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.555 HD12 ' CZ ' ' A' ' 27' ' ' ARG . 7.3 tt -68.11 -20.36 64.92 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.349 178.541 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.475 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 2.2 pt-20 -107.02 -2.62 20.92 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.458 -179.274 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.581 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 15.9 m -122.52 88.37 49.42 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.251 -178.837 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -62.19 -31.96 82.72 Favored 'Trans proline' 0 C--N 1.343 0.258 0 C-N-CA 122.1 1.867 . . . . 0.0 111.688 178.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.564 ' O ' ' HB2' ' A' ' 67' ' ' SER . 5.0 mt-10 -78.45 -50.44 11.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.765 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.9 t -69.17 -52.38 28.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.082 0.468 . . . . 0.0 111.424 -178.233 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 1.001 HD21 HD13 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -58.13 -64.3 0.96 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.62 -177.882 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.624 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -51.13 -35.04 33.6 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.195 -177.553 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.564 ' HB2' ' O ' ' A' ' 63' ' ' GLU . 0.2 OUTLIER -69.7 -36.41 75.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.9 0.381 . . . . 0.0 110.315 178.428 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -66.32 -56.45 11.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.318 179.005 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.558 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 45.3 t -64.56 -21.07 28.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.492 179.039 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.662 ' O ' HG22 ' A' ' 73' ' ' VAL . 26.7 t70 -56.35 -48.4 76.87 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 176.713 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.473 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 0.8 OUTLIER -68.9 -26.76 65.26 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.751 176.449 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.655 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -60.58 -46.62 89.54 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.527 -0.761 . . . . 0.0 111.07 179.898 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.662 HG22 ' O ' ' A' ' 70' ' ' ASP . 3.6 m -61.24 -29.5 45.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 177.392 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.473 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -70.32 -28.41 65.14 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.151 179.248 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.581 HG22 ' O ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -69.87 -36.58 70.06 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.171 0 CA-C-O 120.811 0.338 . . . . 0.0 110.571 179.544 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.481 ' CD1' ' HB3' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -71.49 -53.99 12.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.134 -179.917 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.469 ' HG3' ' O ' ' A' ' 74' ' ' ALA . 0.0 OUTLIER -52.58 -37.97 59.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.272 0.558 . . . . 0.0 110.283 -179.965 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.11 -21.9 42.73 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.762 178.487 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 0.456 ' HB2' ' O ' ' A' ' 75' ' ' VAL . 31.7 t60 . . . . . 0 C--N 1.332 -0.163 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.133 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.83 0.347 . . . . 0.0 110.706 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 7.9 mt -66.7 -69.11 0.33 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.459 179.137 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 7' ' ' ASN . . . . . 0.494 ' HA ' ' HD3' ' B' ' 8' ' ' PRO . 1.4 t-20 -94.68 129.38 36.46 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.961 179.115 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 8' ' ' PRO . . . . . 0.494 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 3.6 Cg_exo -76.49 -4.8 15.46 Favored 'Trans proline' 0 N--CA 1.462 -0.358 0 C-N-CA 122.563 2.175 . . . . 0.0 112.344 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -123.61 48.7 1.82 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.986 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 10' ' ' ALA . . . . . 0.541 ' HB1' ' HB2' ' A' ' 46' ' ' MET . . . -55.44 97.19 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.616 -179.399 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.542 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -122.71 134.07 54.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.039 178.975 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 12' ' ' GLU . . . . . 0.558 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 11.5 tt0 -49.17 173.22 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -177.709 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 13' ' ' PHE . . . . . 0.505 ' CE1' ' HG ' ' A' ' 48' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.52 -0.184 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.712 179.005 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 15.9 mttt . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.85 0.357 . . . . 0.0 110.857 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.542 ' CE2' ' HG2' ' B' ' 11' ' ' LYS . 1.1 t80 . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.994 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.774 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 15.0 t . . . . . 0 N--CA 1.455 -0.206 0 CA-C-O 120.597 0.237 . . . . 0.0 110.399 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.24 -35.65 74.04 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 176.891 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 40.7 t -72.91 -34.29 66.52 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.894 177.405 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.774 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 10.6 mtm -64.15 -35.86 82.17 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.804 177.652 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.704 ' HA ' ' HE2' ' A' ' 23' ' ' MET . 5.6 mp -52.9 -55.63 21.83 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.995 178.273 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.9 -24.73 66.9 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.686 178.022 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.7 m -101.52 25.07 8.82 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.477 -179.222 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.74 ' HB1' ' HB2' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.889 179.678 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.74 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 2.8 mm-40 . . . . . 0 N--CA 1.448 -0.526 0 CA-C-O 120.472 0.177 . . . . 0.0 111.015 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.454 ' O ' HD12 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -46.35 -64.51 0.74 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.894 0.378 . . . . 0.0 110.997 -179.039 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.531 ' H ' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -56.49 -23.14 37.31 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.313 -179.512 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.502 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 2.7 tp60 -73.47 -75.98 0.14 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.771 0.32 . . . . 0.0 111.538 179.555 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' MET . . . . . 0.704 ' HE2' ' HA ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -68.99 -96.58 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 112.613 0.598 . . . . 0.0 112.613 -176.332 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.648 HD22 ' HD3' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -62.13 3.08 0.19 Allowed 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -175.309 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.49 -117.28 10.29 Favored Glycine 0 N--CA 1.445 -0.761 0 N-CA-C 108.258 -1.937 . . . . 0.0 108.258 -174.456 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.526 ' O ' HD13 ' A' ' 24' ' ' LEU . 0.4 OUTLIER -75.49 -69.34 0.49 Allowed 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 168.609 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.787 ' NE ' HD12 ' A' ' 59' ' ' LEU . 9.9 tpt85 -160.44 10.08 0.1 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.188 -1.369 . . . . 0.0 107.768 174.164 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.951 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.09 -71.62 0.12 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 114.549 -1.205 . . . . 0.0 113.728 -173.14 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.639 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -36.28 -48.92 1.69 Allowed Pre-proline 0 CA--C 1.54 0.583 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -176.24 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.656 ' HB2' ' NH1' ' A' ' 27' ' ' ARG . 42.6 Cg_exo -61.4 -41.12 43.35 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 122.511 2.141 . . . . 0.0 113.874 -178.174 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.907 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -69.98 -45.94 66.25 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.359 0.6 . . . . 0.0 109.556 -179.094 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.826 HD11 HD23 ' A' ' 28' ' ' LEU . 0.7 OUTLIER -75.96 -12.09 14.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.021 177.381 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.639 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 6.0 tp60 -62.44 -38.86 91.4 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.315 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.76 -31.22 70.11 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 174.769 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' MET . . . . . 0.499 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 5.7 mtt -100.23 27.35 5.72 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.261 178.121 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.639 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -64.92 -32.71 7.04 Favored Pre-proline 0 CA--C 1.536 0.405 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -177.171 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.554 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 61.5 Cg_exo -37.12 -30.39 0.11 Allowed 'Trans proline' 0 C--N 1.36 1.178 0 C-N-CA 122.187 1.925 . . . . 0.0 112.36 179.618 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.848 HG21 HG13 ' A' ' 73' ' ' VAL . 37.2 m -78.65 -84.62 0.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.183 177.42 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.452 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.4 OUTLIER -171.12 49.84 0.03 OUTLIER 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.39 179.219 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.471 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -38.23 -38.11 0.33 Allowed 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.378 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.639 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -51.29 -55.49 19.11 Favored Glycine 0 CA--C 1.518 0.226 0 C-N-CA 121.248 -0.501 . . . . 0.0 113.789 -179.185 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.828 ' HB3' HD11 ' A' ' 76' ' ' LEU . 3.5 tptm -77.18 -32.21 55.94 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -177.902 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.8 HD12 HG21 ' A' ' 32' ' ' ILE . 0.5 OUTLIER -54.96 -56.55 10.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.121 -179.255 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.951 ' HA ' HD22 ' A' ' 28' ' ' LEU . 11.8 t -51.37 -44.52 62.13 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.616 179.566 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.763 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -48.63 -68.86 1.13 Allowed Glycine 0 C--O 1.227 -0.297 0 CA-C-N 115.917 -0.583 . . . . 0.0 113.321 -179.376 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.605 ' SD ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.41 -46.76 76.61 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -178.192 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.412 HD22 ' N ' ' A' ' 47' ' ' LEU . 3.4 mm? -80.31 7.93 8.53 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -178.911 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.634 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.94 -13.97 60.71 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.86 0.362 . . . . 0.0 110.767 179.894 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.544 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.0 mt-10 -78.6 19.18 0.5 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.731 178.629 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.764 HD11 ' NZ ' ' A' ' 68' ' ' LYS . 1.2 tt -83.22 163.97 2.84 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.982 -179.783 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.476 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 1.8 m-20 -71.25 156.37 39.62 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.836 -179.108 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.831 ' HA ' HD23 ' A' ' 55' ' ' LEU . 3.2 m120 -87.12 -28.21 22.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.75 176.956 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.7 m -74.14 -30.99 62.55 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 176.874 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.476 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.6 OUTLIER -75.4 -31.17 60.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.31 178.926 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.831 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.5 OUTLIER -59.28 -45.98 89.77 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.404 179.845 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.468 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 38.6 tp -58.8 -44.24 90.72 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.817 179.438 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.466 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 4.6 m80 -65.04 -38.73 91.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.126 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.563 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -60.62 -38.02 83.34 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.101 0.477 . . . . 0.0 110.14 178.828 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.787 HD12 ' NE ' ' A' ' 27' ' ' ARG . 7.6 tt -69.61 -20.25 63.63 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.411 178.837 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 57' ' ' HIS . 4.3 pt-20 -106.91 -1.45 22.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.517 -179.34 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.594 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 5.9 m -122.95 78.91 50.52 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.223 -179.556 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.452 ' O ' ' HB2' ' A' ' 66' ' ' ARG . 50.5 Cg_exo -55.69 -33.19 86.67 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.243 1.962 . . . . 0.0 111.993 179.408 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -78.21 -50.39 12.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.824 -179.363 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.594 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 50.2 m -70.43 -51.35 30.04 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.92 0.391 . . . . 0.0 111.535 -177.793 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.907 HD21 HD13 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -57.81 -59.33 5.39 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.282 -178.658 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.645 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -52.51 -30.46 30.41 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.796 -178.379 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.539 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.4 OUTLIER -69.44 -38.33 77.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.106 0.479 . . . . 0.0 110.134 178.005 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.764 ' NZ ' HD11 ' A' ' 50' ' ' ILE . 5.7 mtpp -65.65 -59.01 4.38 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.287 178.661 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.515 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 52.8 t -61.73 -21.53 26.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.606 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.539 ' HB3' ' O ' ' A' ' 67' ' ' SER . 16.2 t70 -54.79 -49.45 70.93 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.78 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -68.84 -30.51 69.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.766 176.889 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.675 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -57.7 -40.57 79.82 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.105 177.887 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.848 HG13 HG21 ' A' ' 38' ' ' THR . 33.4 t -62.21 -31.11 50.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.526 176.759 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.3 -37.14 66.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.53 179.827 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.516 HG22 ' O ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -58.71 -28.17 36.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.963 0.411 . . . . 0.0 110.159 179.782 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.828 HD11 ' HB3' ' A' ' 42' ' ' LYS . 3.1 mm? -71.35 -53.72 13.2 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.876 178.851 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 20.8 mm100 -51.16 -35.44 35.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.372 179.604 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.56 -26.92 34.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.877 178.494 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 6.3 t60 . . . . . 0 C--N 1.332 -0.186 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.162 -179.514 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 27.5 m-20 . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.809 0.338 . . . . 0.0 110.816 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.18 -85.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.827 179.769 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -74.46 124.29 89.72 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.816 179.571 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -76.59 -0.74 10.77 Favored 'Trans proline' 0 N--CA 1.463 -0.316 0 C-N-CA 122.138 1.892 . . . . 0.0 111.81 179.088 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -123.12 51.15 1.47 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.57 179.437 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 10' ' ' ALA . . . . . 0.412 ' HB1' ' HB2' ' A' ' 46' ' ' MET . . . -60.06 97.91 0.05 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.627 -179.687 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.544 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 2.8 mttp -122.85 138.09 54.75 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.498 178.817 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 12' ' ' GLU . . . . . 0.628 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 4.9 mp0 -48.43 166.03 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.026 0.441 . . . . 0.0 112.13 -178.841 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 13' ' ' PHE . . . . . 0.763 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.8 OUTLIER . . . . . 0 C--N 1.332 -0.174 0 CA-C-N 115.87 -0.604 . . . . 0.0 109.699 178.726 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.93 0.395 . . . . 0.0 110.775 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.023 -179.28 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.732 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 3.0 t . . . . . 0 CA--C 1.521 -0.155 0 CA-C-O 120.566 0.222 . . . . 0.0 110.624 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.49 -34.92 69.57 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 177.533 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.3 t -72.22 -36.76 69.23 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.947 177.444 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.732 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 3.4 mtm -64.59 -37.56 87.99 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.422 178.248 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.792 HD21 ' HB3' ' A' ' 24' ' ' LEU . 65.1 mt -52.76 -50.38 63.62 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.946 179.37 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.39 -26.02 67.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.816 177.642 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.4 m -101.67 15.19 29.7 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.667 -178.886 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.946 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 CA--C 1.533 0.323 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.745 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.946 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 15.7 tp10 . . . . . 0 N--CA 1.456 -0.142 0 CA-C-O 120.773 0.32 . . . . 0.0 110.594 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.592 ' HG2' ' N ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -50.87 -51.12 54.66 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.326 -179.151 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.592 ' N ' ' HG2' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -56.37 -26.55 53.29 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.514 -178.327 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.799 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 2.5 tp-100 -73.42 -76.65 0.12 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.92 0.391 . . . . 0.0 111.702 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' MET . . . . . 0.651 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -68.99 -97.73 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -176.492 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.792 ' HB3' HD21 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -59.05 -1.37 0.17 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -176.014 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.526 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 65.06 -118.17 11.69 Favored Glycine 0 N--CA 1.442 -0.901 0 N-CA-C 108.524 -1.83 . . . . 0.0 108.524 -174.764 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.475 ' HG2' HG22 ' A' ' 50' ' ' ILE . 0.4 OUTLIER -76.34 -67.07 0.73 Allowed 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 169.737 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.852 ' HG3' HD21 ' A' ' 31' ' ' LEU . 9.5 tpt180 -160.03 10.11 0.11 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 114.507 -1.224 . . . . 0.0 108.403 177.031 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.502 HD12 HD11 ' A' ' 32' ' ' ILE . 4.2 mm? -57.89 -82.41 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.72 -1.127 . . . . 0.0 113.795 -173.005 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.705 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -33.68 -50.0 0.79 Allowed Pre-proline 0 CA--C 1.537 0.471 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -175.071 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.606 ' CD ' ' HB2' ' A' ' 24' ' ' LEU . 12.2 Cg_endo -58.77 -40.6 71.19 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.415 2.076 . . . . 0.0 113.722 -177.612 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.852 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.52 -47.73 59.01 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 120.077 -0.649 . . . . 0.0 109.79 -179.666 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.522 ' O ' ' HB2' ' A' ' 40' ' ' ALA . 0.3 OUTLIER -73.31 -14.1 16.51 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.156 178.647 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.627 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 55.0 tp60 -62.15 -38.64 89.78 Favored 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 177.016 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.9 -31.1 70.64 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.063 174.625 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' MET . . . . . 0.541 ' HE1' ' HA ' ' A' ' 66' ' ' ARG . 7.0 mtt -101.24 27.54 6.1 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.317 178.062 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.627 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 2.4 p-80 -64.37 -31.91 6.54 Favored Pre-proline 0 CA--C 1.537 0.458 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 -177.306 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.605 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 49.2 Cg_exo -34.71 -34.96 0.1 OUTLIER 'Trans proline' 0 C--N 1.362 1.257 0 C-N-CA 122.29 1.994 . . . . 0.0 112.411 179.399 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.482 HG22 HD12 ' A' ' 76' ' ' LEU . 31.9 m -78.3 -86.52 0.06 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.189 -0.459 . . . . 0.0 109.869 176.765 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.714 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -171.36 62.32 0.03 OUTLIER 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.364 178.406 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.522 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -48.44 -33.29 9.04 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.784 0.326 . . . . 0.0 111.578 179.534 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.648 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -45.26 -59.41 4.62 Favored Glycine 0 CA--C 1.518 0.24 0 CA-C-N 115.841 -0.618 . . . . 0.0 114.169 -178.262 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.866 ' HZ1' ' HA ' ' B' ' 12' ' ' GLU . 0.1 OUTLIER -78.26 -36.13 47.21 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.332 0.494 . . . . 0.0 112.332 -177.622 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.642 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 20.9 mt -53.06 -53.71 20.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.4 -177.657 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.586 HG21 ' CD2' ' A' ' 29' ' ' PHE . 5.1 t -47.9 -43.04 28.48 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-O 121.153 0.502 . . . . 0.0 109.786 177.736 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.889 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -51.78 -66.38 2.6 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.167 -0.924 . . . . 0.0 113.656 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.641 ' SD ' ' HE3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.33 -47.45 75.64 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -177.225 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.444 HD22 ' N ' ' A' ' 47' ' ' LEU . 3.3 mm? -79.98 3.46 20.0 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 121.145 -0.222 . . . . 0.0 111.564 -178.852 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.526 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.13 -11.6 50.17 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.842 0.354 . . . . 0.0 110.913 179.991 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.421 ' OE1' ' HG3' ' B' ' 11' ' ' LYS . 1.3 mm-40 -77.85 16.36 0.72 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.967 0.413 . . . . 0.0 110.554 178.309 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.488 HD11 ' NZ ' ' A' ' 68' ' ' LYS . 0.3 OUTLIER -83.77 158.77 3.64 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.048 -179.496 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.4 ' O ' HG23 ' A' ' 50' ' ' ILE . 2.2 m-20 -71.25 161.7 30.66 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.817 -179.111 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.926 ' HA ' HD23 ' A' ' 55' ' ' LEU . 3.7 m-80 -83.92 -28.6 27.75 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.125 177.777 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.3 t -73.85 -36.67 64.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.081 -0.508 . . . . 0.0 109.961 178.284 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.426 ' HG2' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -75.71 -23.77 56.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.656 179.548 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.926 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -62.61 -47.15 85.02 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 120.916 0.389 . . . . 0.0 109.967 178.939 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.408 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 38.5 tp -58.12 -43.68 87.33 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.526 179.099 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.519 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 0.4 OUTLIER -57.76 -42.09 83.31 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.804 179.257 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.632 ' SD ' ' HE2' ' A' ' 68' ' ' LYS . 19.9 mmt -60.23 -44.08 95.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.072 0.463 . . . . 0.0 110.329 178.528 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.494 HD22 ' NE ' ' A' ' 27' ' ' ARG . 8.4 tp -68.46 -16.29 63.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.777 179.513 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.519 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 0.1 OUTLIER -106.81 0.32 23.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.95 179.51 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.629 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 5.5 m -125.66 82.7 63.29 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.121 -179.591 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -58.32 -35.28 98.87 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.217 1.945 . . . . 0.0 111.935 179.36 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.463 ' O ' ' HB2' ' A' ' 67' ' ' SER . 31.6 mt-10 -78.3 -47.79 17.06 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.887 -179.21 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.629 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 36.9 m -71.7 -53.12 14.52 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.815 0.34 . . . . 0.0 111.709 -177.779 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.81 HD21 HD13 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -57.94 -62.11 2.05 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.302 -178.476 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.675 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.6 OUTLIER -50.14 -34.05 20.94 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.861 -178.086 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.479 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.5 OUTLIER -69.6 -38.05 77.15 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.105 0.478 . . . . 0.0 110.228 177.806 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.725 ' HG2' HD22 ' B' ' 6' ' ' LEU . 0.2 OUTLIER -65.96 -58.2 6.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.316 178.938 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.542 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 28.0 t -62.99 -18.99 22.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.509 179.037 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.68 ' O ' HG22 ' A' ' 73' ' ' VAL . 25.1 t0 -56.14 -49.1 74.88 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 176.374 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.491 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 0.5 OUTLIER -69.08 -24.71 64.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.765 176.481 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.642 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -63.91 -43.85 94.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.811 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.68 HG22 ' O ' ' A' ' 70' ' ' ASP . 2.5 m -61.35 -29.93 46.95 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 177.15 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -68.41 -38.33 81.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.103 178.82 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.618 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.15 -35.44 52.9 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-O 120.995 0.426 . . . . 0.0 110.042 179.221 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.714 ' HG ' ' HB3' ' A' ' 39' ' ' LEU . 2.6 tm? -69.26 -47.06 65.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.065 178.487 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -54.25 -37.26 64.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.652 179.54 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.24 -23.95 37.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.784 178.815 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 16.0 t-160 . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.992 -179.884 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 24.1 m-20 . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.793 0.33 . . . . 0.0 110.876 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.725 HD22 ' HG2' ' A' ' 68' ' ' LYS . 11.9 mt -66.07 -89.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.765 179.72 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 7' ' ' ASN . . . . . 0.452 ' HA ' ' HD3' ' B' ' 8' ' ' PRO . 1.3 t-20 -77.47 119.75 78.7 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.955 179.299 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 8' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 9.8 Cg_exo -72.34 0.26 7.66 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.344 2.029 . . . . 0.0 111.953 179.416 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 9' ' ' ASN . . . . . 0.428 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 17.4 m-80 -123.01 45.55 2.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.605 179.494 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 10' ' ' ALA . . . . . 0.639 ' HB1' ' HB2' ' A' ' 46' ' ' MET . . . -59.49 98.45 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.505 -179.377 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.4 OUTLIER -117.25 138.16 51.91 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.666 179.185 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 12' ' ' GLU . . . . . 0.866 ' HA ' ' HZ1' ' A' ' 42' ' ' LYS . 0.4 OUTLIER -50.89 160.82 0.42 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.159 -0.473 . . . . 0.0 112.127 -178.758 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 13' ' ' PHE . . . . . 0.889 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.7 OUTLIER . . . . . 0 N--CA 1.463 0.179 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.472 177.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 12.4 mttm . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.894 0.378 . . . . 0.0 110.93 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.458 ' HD1' ' HA ' ' B' ' 19' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.842 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.742 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 5.2 t . . . . . 0 CA--C 1.522 -0.125 0 CA-C-O 120.746 0.308 . . . . 0.0 110.35 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.4 -37.68 78.62 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 176.763 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.3 t -66.96 -35.36 79.8 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.805 177.194 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.742 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.5 mtm -64.46 -38.52 91.3 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.19 178.155 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.93 HD21 ' HB3' ' A' ' 24' ' ' LEU . 49.0 mt -52.29 -44.56 65.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.342 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.27 -34.3 77.68 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.96 178.288 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.4 m -101.75 18.49 20.31 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.676 -179.041 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.513 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.089 -179.713 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.513 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.4 OUTLIER . . . . . 0 N--CA 1.455 -0.216 0 CA-C-O 120.592 0.234 . . . . 0.0 110.879 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.665 ' HG2' ' N ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -48.64 -51.9 25.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.905 -176.8 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.686 ' HD2' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -59.97 -23.29 63.48 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.567 -0.453 . . . . 0.0 111.692 -177.586 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.686 ' N ' ' HD2' ' A' ' 21' ' ' LYS . 5.2 tt0 -73.5 -78.97 0.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.041 0.448 . . . . 0.0 111.682 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' MET . . . . . 0.698 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.66 -96.22 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -175.898 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.93 ' HB3' HD21 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -60.77 -2.17 0.51 Allowed 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -174.931 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.68 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.65 -116.52 9.11 Favored Glycine 0 N--CA 1.447 -0.576 0 N-CA-C 108.449 -1.861 . . . . 0.0 108.449 -174.488 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.761 ' HG2' HG22 ' A' ' 50' ' ' ILE . 0.3 OUTLIER -76.28 -68.56 0.57 Allowed 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 168.646 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.871 ' HE ' HD13 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -159.92 9.03 0.1 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.176 -1.374 . . . . 0.0 108.022 174.445 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.982 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.03 -74.39 0.07 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.139 -1.391 . . . . 0.0 113.896 -172.982 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.658 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -35.38 -49.14 1.26 Allowed Pre-proline 0 CA--C 1.538 0.504 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -175.646 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.576 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 52.0 Cg_exo -58.83 -43.35 44.55 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 122.316 2.011 . . . . 0.0 113.648 -178.722 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.779 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.54 -47.2 61.52 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 120.269 -0.572 . . . . 0.0 110.002 -178.509 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.836 HG21 HD12 ' A' ' 43' ' ' ILE . 0.6 OUTLIER -73.43 -12.93 15.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.909 178.073 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.602 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.7 OUTLIER -62.19 -38.54 89.51 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 177.147 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.56 -31.4 70.58 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.039 174.648 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' MET . . . . . 0.518 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 6.6 mtt -100.84 27.99 5.55 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.228 178.061 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.602 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 3.7 p-80 -64.9 -31.69 5.77 Favored Pre-proline 0 CA--C 1.536 0.407 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 -177.232 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.554 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 63.0 Cg_exo -37.75 -29.97 0.13 Allowed 'Trans proline' 0 C--N 1.362 1.286 0 C-N-CA 122.137 1.891 . . . . 0.0 112.278 179.236 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.809 HG21 HG13 ' A' ' 73' ' ' VAL . 6.4 m -78.14 -86.11 0.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.04 177.137 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.495 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.3 OUTLIER -171.39 50.52 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.488 -0.323 . . . . 0.0 111.246 178.642 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.44 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -37.78 -36.84 0.2 Allowed 'General case' 0 N--CA 1.467 0.413 0 O-C-N 123.312 0.382 . . . . 0.0 111.92 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.658 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.34 -60.1 5.97 Favored Glycine 0 C--N 1.329 0.173 0 CA-C-N 116.042 -0.526 . . . . 0.0 113.821 -179.409 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.556 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -77.32 -30.47 54.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.983 0.392 . . . . 0.0 111.989 -177.681 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.836 HD12 HG21 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -54.0 -54.95 16.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 C-N-CA 121.077 -0.249 . . . . 0.0 111.155 -179.281 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.982 ' HA ' HD22 ' A' ' 28' ' ' LEU . 10.7 t -51.56 -47.57 63.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.628 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.577 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -49.8 -59.76 7.08 Favored Glycine 0 CA--C 1.518 0.264 0 C-N-CA 121.161 -0.543 . . . . 0.0 113.309 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.549 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -56.32 -53.79 53.08 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.788 0.294 . . . . 0.0 111.475 -178.731 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.581 ' HB2' HD21 ' A' ' 28' ' ' LEU . 2.9 mm? -80.02 10.19 4.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.819 -178.414 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.577 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.99 -17.62 64.8 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.872 0.368 . . . . 0.0 110.731 179.602 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.485 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.0 mm-40 -74.79 17.74 0.2 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.862 179.465 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.761 HG22 ' HG2' ' A' ' 26' ' ' GLU . 0.1 OUTLIER -83.98 160.08 3.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.88 -179.977 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.493 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 1.5 m-20 -70.71 156.82 39.01 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -178.334 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.958 ' HA ' HD23 ' A' ' 55' ' ' LEU . 3.5 m-80 -84.21 -29.62 26.41 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.237 178.153 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.9 m -74.22 -35.18 63.88 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.422 0.629 . . . . 0.0 109.594 177.486 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.493 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -76.58 -21.6 55.39 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.688 179.657 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.958 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.9 OUTLIER -65.66 -47.54 75.16 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-O 121.001 0.429 . . . . 0.0 110.04 178.782 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.431 ' N ' HD12 ' A' ' 55' ' ' LEU . 2.7 tt -56.18 -44.31 79.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.685 179.827 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -56.61 -39.65 73.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.568 -179.503 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.527 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -57.36 -52.82 63.81 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -178.815 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.871 HD13 ' HE ' ' A' ' 27' ' ' ARG . 0.5 OUTLIER -61.53 -19.69 62.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.736 0.303 . . . . 0.0 111.171 -179.364 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -102.57 -6.22 23.05 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.603 178.928 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.555 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 52.4 m -122.72 81.76 48.65 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.729 -179.757 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.43 ' O ' ' HB2' ' A' ' 66' ' ' ARG . 19.6 Cg_endo -58.01 -30.57 90.45 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.338 2.026 . . . . 0.0 112.189 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -78.4 -50.5 11.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.954 -179.415 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.436 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 73.1 m -74.6 -29.67 61.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.967 -177.539 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.779 HD21 HD13 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -78.68 -60.03 2.54 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.006 -178.329 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.704 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -53.6 -31.72 48.13 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.636 -0.425 . . . . 0.0 110.539 -178.674 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.487 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 3.0 m -67.82 -36.53 80.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.096 177.687 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.495 ' HE2' ' HE2' ' A' ' 58' ' ' MET . 0.3 OUTLIER -65.31 -60.1 3.35 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.973 178.399 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.48 ' CG1' HG23 ' A' ' 32' ' ' ILE . 69.5 t -64.16 -19.71 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.731 -179.629 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.487 ' HB3' ' O ' ' A' ' 67' ' ' SER . 10.9 t70 -55.25 -50.67 68.89 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 176.84 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.442 ' O ' HG13 ' A' ' 75' ' ' VAL . 0.4 OUTLIER -69.22 -30.69 68.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.773 176.777 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.705 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -57.29 -42.41 81.64 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.307 178.299 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.809 HG13 HG21 ' A' ' 38' ' ' THR . 20.9 t -61.8 -31.12 50.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 176.888 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.417 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -73.51 -37.0 65.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.54 179.798 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.565 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.64 -27.81 35.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-O 120.95 0.405 . . . . 0.0 110.207 179.803 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.582 HD21 HG12 ' A' ' 43' ' ' ILE . 3.0 mm? -71.68 -54.85 9.01 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.639 178.526 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 64.3 mm-40 -51.18 -33.23 26.31 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.372 179.49 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.28 -32.76 33.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.745 178.24 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 71.2 t60 . . . . . 0 C--N 1.331 -0.207 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.873 179.976 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 5' ' ' ASN . . . . . 0.413 ' HB2' ' HG2' ' A' ' 71' ' ' GLU . 25.7 m120 . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.802 0.334 . . . . 0.0 110.847 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.3 mt -73.11 -78.5 0.09 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.678 179.477 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -84.0 125.18 73.42 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.022 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -77.78 0.54 9.73 Favored 'Trans proline' 0 N--CA 1.461 -0.406 0 C-N-CA 122.195 1.93 . . . . 0.0 112.038 178.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 9' ' ' ASN . . . . . 0.482 ' HB3' ' NZ ' ' B' ' 11' ' ' LYS . 55.9 m-80 -123.44 49.63 1.68 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.796 179.66 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 10' ' ' ALA . . . . . 0.549 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.66 97.57 0.06 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.576 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.485 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 0.3 OUTLIER -117.41 167.71 11.02 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.478 178.559 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -67.25 167.93 11.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.691 0.281 . . . . 0.0 110.86 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 13' ' ' PHE . . . . . 0.432 ' CZ ' HD21 ' A' ' 48' ' ' LEU . 1.0 OUTLIER . . . . . 0 C--N 1.332 -0.169 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.855 -179.61 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 18' ' ' LYS . . . . . 0.645 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 3.4 mttt . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.77 0.319 . . . . 0.0 110.842 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.95 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.805 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 5.0 t . . . . . 0 CA--C 1.52 -0.182 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.45 ' HB2' ' OE1' ' A' ' 33' ' ' GLN . . . -59.39 -40.8 87.75 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 176.607 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 37.4 t -67.8 -34.6 77.09 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.555 177.071 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.805 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.7 mtm -64.37 -39.3 93.6 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.264 177.99 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.813 HD21 ' HB3' ' A' ' 24' ' ' LEU . 45.5 mt -52.3 -45.67 65.63 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.274 -179.883 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.15 -34.04 77.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.994 178.305 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 37.3 m -101.87 21.65 14.27 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.594 -178.875 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.574 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.33 -0.253 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.159 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.574 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.71 0.291 . . . . 0.0 110.756 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.505 ' OE1' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -48.19 -62.88 1.26 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.347 -179.735 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.745 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -55.7 -23.37 28.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.703 -178.103 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.507 ' H ' ' HD3' ' A' ' 21' ' ' LYS . 15.8 tt0 -73.08 -79.15 0.08 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.894 0.378 . . . . 0.0 111.766 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' MET . . . . . 0.647 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.46 -95.9 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -176.602 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.813 ' HB3' HD21 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -59.77 -1.56 0.28 Allowed 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -175.428 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.587 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 65.08 -116.05 8.45 Favored Glycine 0 N--CA 1.445 -0.733 0 N-CA-C 108.548 -1.821 . . . . 0.0 108.548 -174.374 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.85 -68.51 0.57 Allowed 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 168.941 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.847 ' HB2' HD13 ' A' ' 55' ' ' LEU . 10.7 tpt180 -159.89 7.69 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 114.136 -1.393 . . . . 0.0 107.794 175.332 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.793 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -60.71 -71.98 0.12 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.236 -1.347 . . . . 0.0 113.93 -173.414 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.64 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -35.5 -48.12 1.24 Allowed Pre-proline 0 CA--C 1.541 0.603 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -175.926 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.61 ' CD ' ' HB2' ' A' ' 24' ' ' LEU . 20.9 Cg_endo -64.18 -39.11 32.39 Favored 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 122.201 1.934 . . . . 0.0 113.573 -178.027 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 1.02 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.14 -45.92 65.83 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.764 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.74 HG21 HD12 ' A' ' 43' ' ' ILE . 0.6 OUTLIER -74.24 -13.72 15.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.932 177.6 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.562 ' HB3' ' O ' ' A' ' 30' ' ' PRO . 1.4 tt0 -62.27 -38.19 88.37 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 177.821 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.04 -31.0 68.41 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 175.153 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' MET . . . . . 0.517 ' HE1' ' HA ' ' A' ' 66' ' ' ARG . 4.8 mtt -100.34 27.15 5.91 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.026 177.886 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.808 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 8.5 p-80 -66.32 -30.84 3.83 Favored Pre-proline 0 CA--C 1.536 0.439 0 N-CA-C 113.719 1.007 . . . . 0.0 113.719 -176.438 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.808 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 4.1 Cg_exo -39.19 -28.93 0.18 Allowed 'Trans proline' 0 C--N 1.361 1.203 0 C-N-CA 122.271 1.981 . . . . 0.0 112.098 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.845 HG21 HG13 ' A' ' 73' ' ' VAL . 32.9 m -78.43 -83.85 0.08 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.393 177.637 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.48 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.2 OUTLIER -171.09 48.21 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.369 179.277 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.435 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -37.41 -37.85 0.21 Allowed 'General case' 0 N--CA 1.469 0.477 0 O-C-N 123.307 0.379 . . . . 0.0 111.975 -179.406 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.64 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.2 -59.76 6.13 Favored Glycine 0 C--N 1.33 0.235 0 CA-C-N 116.139 -0.482 . . . . 0.0 113.815 -179.259 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.889 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -77.49 -30.99 53.35 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.106 0.409 . . . . 0.0 112.106 -177.587 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.74 HD12 HG21 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -54.09 -56.24 10.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.113 -179.249 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.793 ' HA ' HD22 ' A' ' 28' ' ' LEU . 9.1 t -47.89 -49.34 30.04 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.083 -179.381 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.572 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -49.56 -61.94 5.19 Favored Glycine 0 CA--C 1.521 0.423 0 C-N-CA 121.153 -0.546 . . . . 0.0 113.595 -179.375 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.599 ' SD ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.2 -62.87 1.38 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.815 0.307 . . . . 0.0 111.827 -177.79 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.701 ' HB2' HD21 ' A' ' 28' ' ' LEU . 1.6 mm? -70.17 1.74 4.43 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 -177.785 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.591 ' HA ' HD13 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -66.52 -8.76 28.78 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.942 -0.303 . . . . 0.0 111.161 179.924 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.491 ' HG3' ' O ' ' B' ' 9' ' ' ASN . 2.7 mm-40 -74.65 16.14 0.3 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.414 0.626 . . . . 0.0 109.531 176.755 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.751 HD11 ' NZ ' ' A' ' 68' ' ' LYS . 0.2 OUTLIER -82.41 162.94 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.558 -179.833 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.505 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 3.5 m-20 -70.7 160.8 31.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.9 0.381 . . . . 0.0 111.873 -178.728 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.865 ' HA ' HD23 ' A' ' 55' ' ' LEU . 12.1 m-80 -89.12 -29.35 19.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.689 177.272 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -73.9 -30.72 62.76 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 176.768 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.505 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.1 OUTLIER -78.22 -28.87 48.04 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.675 178.981 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.865 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.9 OUTLIER -58.69 -44.84 90.41 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 179.428 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.639 ' HA ' HD11 ' A' ' 59' ' ' LEU . 8.0 tt -57.74 -49.18 77.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.37 177.779 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -57.06 -22.64 40.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.685 -179.682 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.689 ' HB3' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -71.27 -53.67 13.52 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -178.754 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.865 ' H ' HD13 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -68.11 -7.39 29.25 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 119.997 -0.681 . . . . 0.0 110.691 179.891 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.472 ' HG3' ' O ' ' A' ' 56' ' ' LEU . 4.9 mt-10 -99.46 -11.38 21.15 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.926 176.237 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.546 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 3.4 m -122.32 85.56 47.43 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.184 -179.026 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -62.51 -33.4 78.77 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.186 1.924 . . . . 0.0 111.65 178.586 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -78.44 -47.02 18.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.485 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.499 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 1.9 m -71.37 -54.9 9.19 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.917 0.389 . . . . 0.0 111.58 -178.304 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 1.02 HD21 HD13 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -58.21 -62.16 2.03 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.707 -177.805 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.688 ' N ' HD13 ' A' ' 65' ' ' LEU . 1.5 ttm180 -50.47 -37.16 36.94 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.746 -0.381 . . . . 0.0 111.345 -177.374 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.61 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 1.4 t -69.47 -34.53 74.5 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.312 0.577 . . . . 0.0 110.172 178.144 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.751 ' NZ ' HD11 ' A' ' 50' ' ' ILE . 3.0 ttpp -65.91 -57.23 8.33 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.161 178.716 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.528 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 37.1 t -64.93 -18.89 24.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.25 178.457 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.61 ' HB3' ' O ' ' A' ' 67' ' ' SER . 25.6 t70 -54.29 -48.72 70.96 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 176.727 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.435 ' HB3' HD13 ' B' ' 6' ' ' LEU . 18.5 tt0 -66.08 -35.17 79.79 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.682 176.813 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.643 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -55.33 -40.74 71.57 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.35 178.044 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.845 HG13 HG21 ' A' ' 38' ' ' THR . 9.9 t -60.7 -34.21 57.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.026 177.516 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.38 -35.09 65.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.696 -179.543 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.518 HG22 ' O ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -57.35 -29.68 33.68 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-O 121.019 0.438 . . . . 0.0 109.899 179.53 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.889 HD11 ' HB3' ' A' ' 42' ' ' LYS . 3.7 mm? -71.93 -54.95 8.43 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.772 178.11 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -50.91 -33.81 25.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.252 179.65 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.54 -32.59 32.18 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.662 177.794 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 84.1 t60 . . . . . 0 C--N 1.331 -0.222 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.077 -179.834 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 2.8 m120 . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.809 0.338 . . . . 0.0 110.977 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.487 HD21 ' HG2' ' A' ' 68' ' ' LYS . 7.2 tp -69.58 -72.76 0.18 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.09 -179.769 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 7' ' ' ASN . . . . . 0.534 ' HB2' HD12 ' A' ' 47' ' ' LEU . 1.5 t-20 -88.95 130.24 45.39 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.985 179.668 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 8' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 3.4 Cg_exo -76.66 -0.76 10.82 Favored 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 122.476 2.117 . . . . 0.0 112.007 179.347 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 9' ' ' ASN . . . . . 0.491 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 68.9 m-20 -123.23 48.06 1.89 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.005 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 10' ' ' ALA . . . . . 0.579 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.37 99.15 0.07 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.812 -179.746 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.473 ' O ' ' HA ' ' A' ' 46' ' ' MET . 0.0 OUTLIER -122.37 153.58 38.83 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.679 178.407 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 12' ' ' GLU . . . . . 0.576 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 5.7 tt0 -55.4 169.85 0.27 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.916 0.388 . . . . 0.0 111.511 -179.464 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 13' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.129 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.581 179.554 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 18' ' ' LYS . . . . . 0.745 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.877 0.37 . . . . 0.0 110.716 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.413 ' HE2' ' HB2' ' B' ' 11' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.984 -179.606 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.737 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 8.9 t . . . . . 0 CA--C 1.522 -0.126 0 CA-C-O 120.566 0.222 . . . . 0.0 110.89 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.41 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.09 -37.11 76.36 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 177.381 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.4 t -70.45 -34.01 71.96 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.884 177.559 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.737 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 11.8 mtm -64.29 -36.41 84.02 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 177.63 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.598 HD11 ' HB3' ' A' ' 24' ' ' LEU . 2.0 mp -52.12 -52.47 51.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.996 178.979 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.33 -28.7 68.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.233 178.478 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.2 p -101.4 17.73 21.92 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.953 -178.097 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.576 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.696 -0.229 . . . . 0.0 111.0 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.576 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.5 OUTLIER . . . . . 0 N--CA 1.455 -0.224 0 CA-C-O 120.654 0.264 . . . . 0.0 111.11 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.466 ' HA ' HD11 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -46.52 -60.5 2.32 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.745 -177.812 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.618 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -56.05 -22.38 27.19 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.913 -177.617 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.618 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 5.9 tt0 -73.37 -78.76 0.09 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.013 0.435 . . . . 0.0 111.428 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' MET . . . . . 0.628 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.3 -97.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.68 -176.396 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.628 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -59.62 -2.19 0.33 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -175.714 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.443 ' HA3' HD11 ' A' ' 48' ' ' LEU . . . 65.21 -115.55 7.85 Favored Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 108.672 -1.771 . . . . 0.0 108.672 -174.426 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.499 ' O ' HD13 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -75.8 -69.65 0.48 Allowed 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 169.386 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.919 ' HG2' HD22 ' A' ' 59' ' ' LEU . 4.8 tpt180 -159.48 13.01 0.14 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.377 -1.283 . . . . 0.0 108.156 175.48 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.543 HD12 HD11 ' A' ' 32' ' ' ILE . 4.2 mm? -57.41 -83.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.56 -1.2 . . . . 0.0 113.809 -173.187 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.673 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -33.04 -51.47 0.66 Allowed Pre-proline 0 CA--C 1.536 0.404 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 -174.846 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.593 ' HG2' ' O ' ' A' ' 27' ' ' ARG . 10.5 Cg_endo -56.39 -42.0 70.42 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.394 2.062 . . . . 0.0 113.646 -177.692 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.86 ' HB3' HD11 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.84 -48.26 54.91 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 120.128 -0.629 . . . . 0.0 109.893 -179.665 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.543 HD11 HD12 ' A' ' 28' ' ' LEU . 0.5 OUTLIER -71.33 -14.1 17.51 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.626 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.037 178.424 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.651 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -62.19 -39.29 92.23 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.196 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.77 -29.87 69.94 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.257 -0.883 . . . . 0.0 108.964 174.479 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' MET . . . . . 0.534 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 7.7 mtt -101.99 26.14 7.91 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.349 178.184 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.651 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -64.33 -31.98 6.69 Favored Pre-proline 0 CA--C 1.535 0.392 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -177.897 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.592 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 51.0 Cg_exo -35.0 -34.36 0.1 OUTLIER 'Trans proline' 0 C--N 1.364 1.365 0 C-N-CA 122.16 1.907 . . . . 0.0 112.008 178.924 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.43 ' HB ' ' H ' ' A' ' 39' ' ' LEU . 20.5 m -78.19 -89.63 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 175.723 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.596 HD23 HD11 ' A' ' 76' ' ' LEU . 3.1 tp -171.93 67.63 0.04 OUTLIER 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.427 177.448 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.516 ' HB1' ' HB ' ' A' ' 32' ' ' ILE . . . -50.24 -24.5 2.92 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.804 0.335 . . . . 0.0 111.573 179.542 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.624 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -49.89 -62.98 4.53 Favored Glycine 0 CA--C 1.518 0.265 0 CA-C-N 115.965 -0.562 . . . . 0.0 114.298 -178.177 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.661 ' HB3' HD12 ' A' ' 76' ' ' LEU . 2.4 tptm -77.42 -32.79 54.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 117.169 0.484 . . . . 0.0 112.03 -177.328 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.653 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 18.7 mt -54.21 -55.95 12.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.729 -0.214 . . . . 0.0 111.427 -178.822 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.58 HG21 ' CD2' ' A' ' 29' ' ' PHE . 4.7 t -47.69 -46.86 29.82 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.887 0.375 . . . . 0.0 110.473 179.077 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.717 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -54.44 -61.95 6.7 Favored Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 115.73 -0.668 . . . . 0.0 113.551 -179.559 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.528 ' SD ' ' HG3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.73 -48.07 75.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.859 0.329 . . . . 0.0 111.414 -178.322 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.453 ' O ' ' HB ' ' A' ' 50' ' ' ILE . 3.2 mm? -80.1 2.43 24.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.439 -179.493 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.498 ' HG ' ' CD1' ' B' ' 13' ' ' PHE . 0.0 OUTLIER -65.93 -12.41 54.53 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.979 0.418 . . . . 0.0 110.392 179.333 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -78.95 17.85 0.69 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.277 177.828 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.453 ' HB ' ' O ' ' A' ' 47' ' ' LEU . 0.6 OUTLIER -83.58 162.74 3.07 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.876 -179.53 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.438 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 1.8 m-20 -70.76 158.84 35.6 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.769 -178.854 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.897 ' HA ' HD23 ' A' ' 55' ' ' LEU . 15.5 m-80 -83.58 -28.28 28.65 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.788 177.178 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.645 ' HA ' HD21 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -74.51 -32.03 62.37 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.408 0.623 . . . . 0.0 109.902 177.419 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.438 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 1.0 OUTLIER -77.84 -26.61 49.53 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.483 178.92 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.897 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.5 OUTLIER -62.48 -49.66 74.53 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.654 179.984 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.692 ' HA ' HD21 ' A' ' 59' ' ' LEU . 0.4 OUTLIER -59.59 -40.98 89.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.985 -179.441 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 3.3 m-70 -63.06 -20.61 65.5 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.634 -179.406 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.533 ' HE2' ' HA ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -76.89 -60.0 2.54 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -178.77 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.919 HD22 ' HG2' ' A' ' 27' ' ' ARG . 2.5 pt? -66.69 -4.06 8.04 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.375 179.662 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.456 ' HB3' ' O ' ' A' ' 56' ' ' LEU . 1.3 tt0 -104.24 -19.12 14.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.894 177.663 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.446 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 0.5 OUTLIER -122.52 87.14 49.08 Favored Pre-proline 0 C--O 1.223 -0.334 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.134 179.398 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -54.3 -34.11 78.74 Favored 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.469 2.113 . . . . 0.0 112.661 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.634 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.0 -48.7 15.59 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.617 -178.998 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.634 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 23.3 m -72.73 -26.68 61.67 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.176 0.512 . . . . 0.0 111.098 -179.193 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.86 HD11 ' HB3' ' A' ' 31' ' ' LEU . 0.2 OUTLIER -77.8 -65.79 0.92 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.155 -178.6 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.461 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.3 OUTLIER -49.75 -28.39 6.11 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.807 -177.854 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.462 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.5 OUTLIER -68.64 -39.56 80.68 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.25 178.348 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.491 ' HE2' ' HE2' ' A' ' 58' ' ' MET . 0.2 OUTLIER -65.03 -59.91 3.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.211 178.918 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.514 ' CG1' HG23 ' A' ' 32' ' ' ILE . 54.4 t -63.15 -20.51 26.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.007 -179.426 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.622 ' O ' HG22 ' A' ' 73' ' ' VAL . 23.8 t70 -55.07 -49.72 70.94 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 176.726 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.586 ' HG2' ' HB3' ' B' ' 5' ' ' ASN . 49.1 tt0 -68.97 -26.67 65.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.801 176.834 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.653 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -62.63 -51.84 65.69 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.367 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.622 HG22 ' O ' ' A' ' 70' ' ' ASP . 5.3 m -56.73 -28.43 27.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.161 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 177.891 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.538 ' O ' ' HG3' ' A' ' 77' ' ' GLN . . . -72.59 -30.62 64.53 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.342 179.33 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.801 HG12 ' HB2' ' B' ' 5' ' ' ASN . 1.0 OUTLIER -67.44 -37.41 78.86 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.189 0 CA-C-O 120.791 0.329 . . . . 0.0 110.532 179.617 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.661 HD12 ' HB3' ' A' ' 42' ' ' LYS . 0.3 OUTLIER -71.87 -52.7 16.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.945 179.548 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.538 ' HG3' ' O ' ' A' ' 74' ' ' ALA . 1.5 pp0? -56.05 -35.18 66.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.121 0.486 . . . . 0.0 109.997 179.556 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.91 -21.09 40.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.613 178.004 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 11.3 t-160 . . . . . 0 C--N 1.331 -0.207 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.718 179.452 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 5' ' ' ASN . . . . . 0.801 ' HB2' HG12 ' A' ' 75' ' ' VAL . 2.0 m-20 . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.793 0.33 . . . . 0.0 110.929 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' B' ' 6' ' ' LEU . 1.9 mt -67.52 -82.85 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.795 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -74.66 124.18 89.53 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.917 179.758 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.26 1.98 7.73 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.18 1.92 . . . . 0.0 111.791 178.811 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 9' ' ' ASN . . . . . 0.69 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 22.8 m120 -123.23 48.54 1.81 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.7 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.33 98.5 0.06 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.708 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.69 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 19.9 mmtp -122.88 153.09 40.1 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.323 178.204 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -55.26 165.0 0.81 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.863 0.363 . . . . 0.0 111.12 -179.682 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 13' ' ' PHE . . . . . 0.717 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.2 t80 . . . . . 0 C--N 1.331 -0.231 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.741 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 18' ' ' LYS . . . . . 0.456 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.46 0.074 0 CA-C-O 120.693 0.282 . . . . 0.0 110.862 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.331 -0.223 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.013 -179.957 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.756 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 6.9 t . . . . . 0 CA--C 1.523 -0.086 0 CA-C-O 120.537 0.208 . . . . 0.0 110.647 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.448 ' HB2' ' OE1' ' A' ' 33' ' ' GLN . . . -59.41 -35.63 74.34 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 177.341 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 5.5 t -71.23 -34.69 71.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.737 177.365 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.756 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.0 mtm -64.23 -36.25 83.48 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.85 177.692 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.713 HD11 ' HB3' ' A' ' 24' ' ' LEU . 1.9 mp -52.41 -53.53 43.91 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.895 178.768 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.42 -26.74 67.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.976 178.268 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.4 22.84 11.92 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.778 -178.654 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.76 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 CA--C 1.533 0.312 0 CA-C-O 120.611 0.243 . . . . 0.0 111.065 179.81 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.76 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.9 OUTLIER . . . . . 0 N--CA 1.453 -0.28 0 CA-C-O 120.837 0.351 . . . . 0.0 110.608 . . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.11 -63.25 1.21 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.637 -179.565 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.466 ' H ' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -56.17 -21.35 22.35 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.2 -179.087 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.467 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 2.1 tp-100 -73.55 -81.04 0.07 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.973 0.416 . . . . 0.0 111.667 179.571 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 23' ' ' MET . . . . . 0.574 ' SD ' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.67 -97.11 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -176.272 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.713 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -56.93 0.71 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -175.183 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.604 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 65.12 -117.51 10.44 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 108.481 -1.848 . . . . 0.0 108.481 -174.783 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.432 ' HG3' ' HA ' ' A' ' 52' ' ' ASN . 0.3 OUTLIER -75.54 -68.03 0.61 Allowed 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 168.715 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.757 ' HB2' HD13 ' A' ' 55' ' ' LEU . 1.0 OUTLIER -160.51 7.69 0.09 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.121 -1.4 . . . . 0.0 107.914 174.784 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.98 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.73 -73.21 0.09 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.387 -1.279 . . . . 0.0 114.139 -173.064 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.649 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -36.46 -49.23 1.81 Allowed Pre-proline 0 CA--C 1.536 0.426 0 N-CA-C 113.612 0.968 . . . . 0.0 113.612 -175.789 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.6 ' HG3' ' HB2' ' A' ' 24' ' ' LEU . 18.9 Cg_endo -61.76 -39.33 53.56 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 122.19 1.926 . . . . 0.0 113.593 -177.41 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.727 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.15 -46.95 60.49 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 120.26 -0.576 . . . . 0.0 110.087 -179.496 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.596 HD11 HD23 ' A' ' 28' ' ' LEU . 0.7 OUTLIER -72.31 -17.71 18.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.294 -0.412 . . . . 0.0 109.925 177.71 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.636 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 1.0 OUTLIER -63.36 -31.98 73.28 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 176.286 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.25 -27.77 61.76 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 175.011 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 35' ' ' MET . . . . . 0.451 ' HE1' ' HB ' ' A' ' 69' ' ' VAL . 12.2 mtt -99.97 16.82 22.67 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 114.862 -1.063 . . . . 0.0 109.655 177.17 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.81 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 0.4 OUTLIER -63.45 -34.81 13.95 Favored Pre-proline 0 CA--C 1.534 0.345 0 CA-C-N 115.379 -0.828 . . . . 0.0 112.011 -179.235 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.81 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 2.2 Cg_endo -39.87 -30.05 0.35 Allowed 'Trans proline' 0 C--N 1.364 1.369 0 C-N-CA 122.106 1.871 . . . . 0.0 110.713 177.386 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.639 HG21 ' CG1' ' A' ' 73' ' ' VAL . 0.2 OUTLIER -78.18 -84.38 0.08 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.209 175.161 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.716 HD23 HD11 ' A' ' 76' ' ' LEU . 11.7 tp -172.15 63.41 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 177.603 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.34 -176.02 0.06 Allowed 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 175.736 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.649 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . 103.91 -69.21 0.28 Allowed Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.292 -0.956 . . . . 0.0 113.112 179.664 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.693 ' HE2' ' HG2' ' A' ' 46' ' ' MET . 1.0 OUTLIER -77.25 -34.97 55.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.825 0.345 . . . . 0.0 111.04 -179.655 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.698 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 17.6 mt -54.08 -53.03 31.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.108 -179.39 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.98 ' HA ' HD22 ' A' ' 28' ' ' LEU . 8.9 t -54.65 -43.75 72.63 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-O 120.9 0.381 . . . . 0.0 110.313 178.22 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.788 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -48.11 -61.27 5.02 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.573 -0.74 . . . . 0.0 113.457 -178.769 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.792 ' CE ' HG21 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -61.8 -50.08 73.78 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -177.757 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.751 HD13 ' HB2' ' B' ' 7' ' ' ASN . 4.0 mm? -78.75 11.05 2.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.602 0.239 . . . . 0.0 111.493 -179.018 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.632 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -63.79 -29.44 70.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.295 -179.186 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.32 29.02 0.15 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.772 0.32 . . . . 0.0 110.921 179.094 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.549 HD11 ' HZ2' ' A' ' 68' ' ' LYS . 2.5 tt -82.77 169.78 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.365 179.081 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.567 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 16.8 m-20 -67.54 137.59 55.86 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.537 -179.0 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.838 ' HA ' HD23 ' A' ' 55' ' ' LEU . 15.1 m-80 -76.51 -27.71 56.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.171 0.51 . . . . 0.0 109.642 177.198 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 42.6 m -74.05 -31.27 62.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.639 177.437 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.567 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 2.2 mm-40 -77.51 -29.89 52.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.668 178.925 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.838 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -58.85 -46.73 87.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.284 -179.953 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.461 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 33.1 tp -61.64 -43.6 98.55 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.409 178.843 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 28.8 m80 -66.93 -19.41 65.72 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.982 179.79 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.514 ' SD ' ' HA ' ' A' ' 65' ' ' LEU . 17.9 mmt -72.4 -47.51 48.65 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.988 -179.983 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.595 HD23 ' CG ' ' A' ' 27' ' ' ARG . 0.2 OUTLIER -66.33 -20.91 66.22 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.229 -179.831 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -96.54 -7.54 34.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.716 0.293 . . . . 0.0 111.576 -179.316 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.627 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -122.88 88.39 50.51 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.891 -179.951 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -62.63 -32.1 79.24 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.302 2.001 . . . . 0.0 112.052 179.552 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.401 ' O ' ' HB2' ' A' ' 67' ' ' SER . 7.6 mt-10 -78.06 -48.84 15.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.498 -179.776 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 26.1 m -69.49 -48.8 59.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.394 -178.376 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.627 ' HB3' ' O ' ' A' ' 61' ' ' SER . 0.9 OUTLIER -59.75 -64.83 0.81 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.874 -178.662 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.615 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.5 OUTLIER -50.1 -29.38 8.88 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.068 -177.215 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.401 ' HB2' ' O ' ' A' ' 63' ' ' GLU . 0.6 OUTLIER -63.75 -43.96 94.91 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.078 0.466 . . . . 0.0 110.229 178.134 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.722 ' HG2' HD11 ' B' ' 6' ' ' LEU . 25.6 mtpt -66.16 -60.68 2.57 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.937 179.327 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.505 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 75.6 t -61.13 -23.18 29.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.194 -178.542 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.45 ' HB2' ' O ' ' A' ' 66' ' ' ARG . 24.8 t70 -55.58 -49.95 71.37 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 176.612 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.665 ' HG2' ' HB3' ' B' ' 5' ' ' ASN . 0.5 OUTLIER -68.9 -28.16 66.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.69 176.542 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.698 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -59.83 -37.66 79.84 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.068 177.933 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.639 ' CG1' HG21 ' A' ' 38' ' ' THR . 28.4 t -66.43 -29.63 47.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 176.975 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.413 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -71.11 -40.39 71.51 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.292 179.46 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.792 HG21 ' CE ' ' A' ' 46' ' ' MET . 0.9 OUTLIER -54.55 -39.33 45.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-O 120.96 0.41 . . . . 0.0 110.222 179.385 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.716 HD11 HD23 ' A' ' 39' ' ' LEU . 1.2 tt -64.28 -46.45 83.64 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.747 -178.751 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 8.7 mm100 -53.86 -35.85 61.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.263 179.428 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.25 -26.91 35.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.469 177.904 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 4.2 t60 . . . . . 0 C--N 1.332 -0.196 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.847 179.724 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' B' B ' 5' ' ' ASN . . . . . 0.67 ' HB2' HG12 ' A' ' 75' ' ' VAL . 2.8 m120 . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.766 0.317 . . . . 0.0 110.874 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.748 ' HB3' HD11 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -74.15 -87.87 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.408 179.349 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' B' B ' 7' ' ' ASN . . . . . 0.751 ' HB2' HD13 ' A' ' 47' ' ' LEU . 1.7 t-20 -74.41 131.5 80.23 Favored Pre-proline 0 C--N 1.332 -0.176 0 CA-C-N 116.616 -0.265 . . . . 0.0 110.546 178.714 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -75.24 -3.91 14.59 Favored 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.109 1.872 . . . . 0.0 112.096 179.262 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 71.8 m-80 -123.35 49.8 1.65 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.657 179.543 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 10' ' ' ALA . . . . . 0.704 ' HB1' ' HB2' ' A' ' 46' ' ' MET . . . -54.17 95.0 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.714 -179.283 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.645 ' C ' ' HA ' ' A' ' 46' ' ' MET . 6.0 mttp -109.57 124.26 50.82 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.704 179.288 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 12' ' ' GLU . . . . . 0.674 ' HG2' ' HE3' ' A' ' 42' ' ' LYS . 51.6 mt-10 -47.48 173.01 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -177.895 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 13' ' ' PHE . . . . . 0.788 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.4 OUTLIER . . . . . 0 N--CA 1.463 0.192 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.352 -179.929 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.907 0.384 . . . . 0.0 110.735 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 1.7 t80 . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.055 -179.35 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.835 HG21 ' HB3' ' A' ' 29' ' ' PHE . 1.8 t . . . . . 0 N--CA 1.455 -0.187 0 CA-C-O 120.601 0.239 . . . . 0.0 110.469 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.408 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.26 -37.06 76.67 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 177.237 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.4 t -69.08 -35.54 76.61 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.659 177.014 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.722 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.2 mtm -64.17 -36.47 84.16 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.886 177.669 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.755 HD11 ' HB3' ' A' ' 24' ' ' LEU . 2.4 mp -52.27 -48.94 65.0 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.156 179.356 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.02 -31.09 71.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.129 178.903 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 56.8 m -101.44 15.47 28.73 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.757 -178.882 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.591 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.031 179.967 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.691 ' HG3' ' HB3' ' A' ' 22' ' ' GLN . 4.6 tp10 . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.691 0.281 . . . . 0.0 111.081 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.436 ' O ' HD23 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -52.83 -60.08 3.7 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.345 -179.868 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.526 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.86 -20.54 15.91 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.496 -178.171 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.691 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 2.7 tp60 -73.2 -79.98 0.07 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.908 0.385 . . . . 0.0 111.425 179.317 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 23' ' ' MET . . . . . 0.671 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.55 -94.39 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.687 -176.979 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.755 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -62.11 -1.56 0.73 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -175.291 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.55 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.87 -116.71 9.27 Favored Glycine 0 N--CA 1.444 -0.794 0 N-CA-C 108.427 -1.869 . . . . 0.0 108.427 -174.268 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.424 ' O ' HD13 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -76.63 -69.63 0.5 Allowed 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 169.43 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.914 ' HG2' HD22 ' A' ' 59' ' ' LEU . 1.3 tpt180 -159.86 12.46 0.13 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.318 -1.31 . . . . 0.0 107.985 176.09 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.565 HD12 HD11 ' A' ' 32' ' ' ILE . 3.6 mm? -57.54 -76.06 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.488 -1.233 . . . . 0.0 113.606 -173.243 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.835 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -41.0 -46.65 6.97 Favored Pre-proline 0 C--N 1.325 -0.495 0 N-CA-C 113.728 1.01 . . . . 0.0 113.728 -174.653 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.602 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 50.4 Cg_exo -57.53 -43.83 47.55 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.236 1.957 . . . . 0.0 113.818 -178.216 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.851 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.7 -48.83 52.62 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.228 -178.066 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.84 HG21 HD12 ' A' ' 43' ' ' ILE . 0.9 OUTLIER -73.43 -14.52 16.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.522 179.15 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.626 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.7 OUTLIER -60.88 -42.33 97.76 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 177.03 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.65 -30.02 70.66 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.143 174.902 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 35' ' ' MET . . . . . 0.507 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 6.3 mtt -101.41 26.79 6.84 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.657 178.576 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.626 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.4 p-80 -66.04 -32.37 5.61 Favored Pre-proline 0 CA--C 1.537 0.46 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -177.457 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.615 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 44.0 Cg_exo -34.11 -35.9 0.09 OUTLIER 'Trans proline' 0 C--N 1.363 1.318 0 C-N-CA 122.383 2.055 . . . . 0.0 112.466 179.457 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.448 ' HB ' ' H ' ' A' ' 39' ' ' LEU . 1.8 m -78.76 -84.13 0.08 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.816 176.891 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.812 ' HB3' HD22 ' A' ' 76' ' ' LEU . 0.6 OUTLIER -171.36 63.54 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.396 178.212 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.563 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -50.09 -38.29 37.86 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.888 0.375 . . . . 0.0 111.398 179.516 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.582 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -47.94 -47.94 25.24 Favored Glycine 0 CA--C 1.517 0.197 0 CA-C-N 115.782 -0.645 . . . . 0.0 114.13 -178.227 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.616 ' HE3' ' HG3' ' B' ' 12' ' ' GLU . 2.2 tptm -77.74 -42.59 33.66 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -177.192 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.921 HG21 ' HB1' ' A' ' 72' ' ' ALA . 20.3 mt -53.51 -56.51 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 C-N-CA 120.761 -0.376 . . . . 0.0 111.288 -178.267 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.573 HG21 ' CD2' ' A' ' 29' ' ' PHE . 9.8 t -47.04 -46.92 22.49 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 179.234 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.921 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -51.57 -67.51 1.96 Allowed Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 115.33 -0.85 . . . . 0.0 113.212 179.352 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.618 ' HA ' ' C ' ' B' ' 11' ' ' LYS . 0.0 OUTLIER -55.57 -57.75 10.65 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -177.246 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.814 HD23 ' HB2' ' B' ' 7' ' ' ASN . 3.5 mp -79.39 14.52 1.54 Allowed 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -177.068 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.513 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.71 -10.51 47.48 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.235 0.54 . . . . 0.0 109.543 176.359 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.496 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 3.5 mt-10 -80.17 19.89 0.7 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.711 178.96 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.462 HG12 ' HG2' ' A' ' 54' ' ' GLU . 1.3 tt -83.31 162.64 3.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.021 -179.236 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.46 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 4.0 m-20 -70.66 156.78 39.03 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.946 0.403 . . . . 0.0 111.72 -178.449 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.943 ' HA ' HD23 ' A' ' 55' ' ' LEU . 21.2 m-80 -84.09 -30.11 26.26 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.21 178.312 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 8.4 t -73.9 -34.03 64.25 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.369 0.604 . . . . 0.0 109.53 177.342 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.462 ' HG2' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -75.84 -28.54 58.28 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.52 179.147 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.943 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -59.59 -46.54 88.63 Favored 'General case' 0 CA--C 1.522 -0.128 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.298 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.646 ' HA ' HD21 ' A' ' 59' ' ' LEU . 61.7 tp -57.83 -49.39 76.83 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.072 -179.678 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.469 ' O ' ' HB2' ' A' ' 61' ' ' SER . 19.3 m-70 -58.78 -21.61 56.33 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.806 -178.992 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.606 ' HE2' ' HA ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -76.17 -57.99 3.54 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -177.742 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.914 HD22 ' HG2' ' A' ' 27' ' ' ARG . 2.2 pt? -65.73 -6.86 12.88 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.538 -0.465 . . . . 0.0 111.098 -178.864 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -105.98 -9.43 17.07 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.94 0.4 . . . . 0.0 110.634 177.745 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.587 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -122.66 97.93 43.82 Favored Pre-proline 0 C--N 1.331 -0.199 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.099 179.61 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -64.94 -30.07 57.55 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.188 1.925 . . . . 0.0 111.924 179.114 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.451 ' O ' ' HB2' ' A' ' 67' ' ' SER . 3.2 mm-40 -78.31 -51.77 9.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.615 -179.75 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.416 ' HB3' ' HB3' ' A' ' 61' ' ' SER . 47.3 t -69.23 -40.29 78.01 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.887 -177.819 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.851 HD21 HD13 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -77.95 -65.14 1.01 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.177 -176.179 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.686 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -51.06 -33.7 26.83 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.885 -0.326 . . . . 0.0 111.524 -176.797 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.471 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 2.9 m -69.97 -35.84 74.75 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.001 0.429 . . . . 0.0 110.195 178.286 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.33 -52.34 48.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.304 178.717 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.615 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 55.4 t -70.37 -16.37 19.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.484 179.127 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.608 ' O ' HG22 ' A' ' 73' ' ' VAL . 20.1 t0 -58.56 -49.05 78.84 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 176.554 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.54 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 2.4 tp10 -68.7 -21.86 64.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.59 176.258 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.921 ' HB1' HG21 ' A' ' 43' ' ' ILE . . . -64.18 -45.38 88.66 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.633 179.353 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.608 HG22 ' O ' ' A' ' 70' ' ' ASP . 2.2 m -59.66 -29.77 43.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 176.852 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.54 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -67.76 -25.18 65.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.91 178.398 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.752 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.3 m -69.89 -32.72 52.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 178.723 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.812 HD22 ' HB3' ' A' ' 39' ' ' LEU . 8.0 mt -70.98 -57.67 4.32 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.956 179.09 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.529 ' HG3' ' O ' ' A' ' 74' ' ' ALA . 0.0 OUTLIER -51.27 -35.58 38.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.047 179.976 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.16 -26.49 36.01 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.791 177.775 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 23.4 t-80 . . . . . 0 C--N 1.333 -0.118 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.847 179.94 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 5.5 m120 . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.798 0.332 . . . . 0.0 110.943 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.42 HD13 ' HA ' ' B' ' 6' ' ' LEU . 0.0 OUTLIER -66.23 -79.16 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.943 179.829 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' B' B ' 7' ' ' ASN . . . . . 0.814 ' HB2' HD23 ' A' ' 47' ' ' LEU . 2.2 t30 -84.16 127.05 68.21 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.051 -179.841 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -78.65 5.03 5.88 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.236 1.957 . . . . 0.0 111.899 178.593 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -123.54 43.02 3.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.917 179.945 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 10' ' ' ALA . . . . . 0.555 ' HB1' ' HB2' ' A' ' 46' ' ' MET . . . -59.78 85.26 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.702 -179.768 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.618 ' C ' ' HA ' ' A' ' 46' ' ' MET . 0.4 OUTLIER -117.61 128.13 54.63 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.051 178.537 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' B' B ' 12' ' ' GLU . . . . . 0.616 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 6.2 tt0 -46.56 167.47 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -175.846 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 13' ' ' PHE . . . . . 0.921 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.4 OUTLIER . . . . . 0 N--CA 1.463 0.208 0 CA-C-N 115.206 -0.906 . . . . 0.0 109.91 179.605 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.956 0.408 . . . . 0.0 110.724 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.467 ' HD2' ' HB3' ' A' ' 48' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.974 -179.351 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.785 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 8.9 t . . . . . 0 N--CA 1.455 -0.222 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.46 -39.47 83.76 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 176.41 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 7.3 t -67.97 -34.62 76.89 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.734 177.111 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.785 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 9.2 mtm -64.43 -39.18 93.35 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.224 178.07 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.833 HD21 ' HB3' ' A' ' 24' ' ' LEU . 38.5 mt -52.27 -45.91 65.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.406 -179.9 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.15 -33.66 76.28 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.02 178.439 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.9 m -101.52 19.95 16.97 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.559 -179.098 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.454 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.331 -0.237 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.096 -179.97 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.469 ' O ' ' HB3' ' A' ' 22' ' ' GLN . 0.3 OUTLIER . . . . . 0 CA--C 1.526 0.046 0 CA-C-O 120.759 0.314 . . . . 0.0 111.158 . . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.442 ' HG3' ' H ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -46.74 -68.77 0.16 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.351 179.853 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.545 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.54 -20.23 12.5 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.775 -177.195 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.545 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 14.9 tt0 -73.35 -80.05 0.07 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.963 0.411 . . . . 0.0 111.533 179.153 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 23' ' ' MET . . . . . 0.624 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.85 -94.14 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 -176.775 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.833 ' HB3' HD21 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -61.63 1.6 0.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -174.98 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.642 ' CA ' HD21 ' A' ' 48' ' ' LEU . . . 65.1 -117.52 10.47 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 108.598 -1.801 . . . . 0.0 108.598 -174.856 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.492 ' HG2' HG22 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -75.42 -67.25 0.68 Allowed 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 168.985 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.947 ' HG3' HD21 ' A' ' 31' ' ' LEU . 8.7 tpt180 -160.3 6.04 0.08 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.188 -1.369 . . . . 0.0 107.862 174.859 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.825 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.4 OUTLIER -60.01 -75.29 0.06 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.235 -1.348 . . . . 0.0 114.582 -172.175 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.496 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.2 OUTLIER -32.86 -50.81 0.63 Allowed Pre-proline 0 N--CA 1.468 0.468 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -175.484 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.615 ' HG2' ' O ' ' A' ' 27' ' ' ARG . 16.9 Cg_endo -60.25 -40.27 60.72 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 122.132 1.888 . . . . 0.0 113.167 -178.413 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.947 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.16 -48.42 51.97 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.136 179.844 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.726 HD11 HD23 ' A' ' 28' ' ' LEU . 0.9 OUTLIER -68.47 -20.61 25.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.229 -0.442 . . . . 0.0 109.892 178.045 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.658 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 4.9 tp60 -63.44 -32.31 73.72 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 176.839 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.71 -26.04 63.22 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 174.903 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 35' ' ' MET . . . . . 0.465 ' HE1' ' HB ' ' A' ' 69' ' ' VAL . 10.2 mtt -102.03 14.07 32.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.559 -1.2 . . . . 0.0 109.749 177.471 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.788 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 0.0 OUTLIER -62.51 -36.39 26.91 Favored Pre-proline 0 CA--C 1.533 0.293 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.946 -179.388 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.788 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 1.3 Cg_endo -42.5 -26.98 0.67 Allowed 'Trans proline' 0 C--N 1.362 1.246 0 C-N-CA 121.969 1.779 . . . . 0.0 110.691 177.435 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.522 HG21 HG11 ' A' ' 73' ' ' VAL . 0.9 OUTLIER -81.93 -82.12 0.14 Allowed 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.37 175.376 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.439 ' H ' ' HB ' ' A' ' 38' ' ' THR . 0.2 OUTLIER -172.19 65.69 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 178.347 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.477 ' HA ' HD12 ' A' ' 43' ' ' ILE . . . -64.15 -172.52 0.07 Allowed 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 176.098 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.807 ' O ' HG22 ' A' ' 44' ' ' THR . . . 108.38 -106.75 2.38 Favored Glycine 0 C--O 1.227 -0.335 0 C-N-CA 120.172 -1.014 . . . . 0.0 113.056 179.476 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.469 ' HA ' ' HD3' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -56.8 -22.51 36.72 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.659 0.266 . . . . 0.0 111.622 -178.077 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.654 HG12 ' HB2' ' A' ' 76' ' ' LEU . 40.7 mt -54.09 -46.2 66.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.76 0.314 . . . . 0.0 110.934 179.684 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.825 ' HA ' HD22 ' A' ' 28' ' ' LEU . 15.4 t -57.14 -44.81 83.74 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.264 -179.606 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -49.36 -43.53 34.79 Favored Glycine 0 CA--C 1.519 0.288 0 C-N-CA 121.2 -0.524 . . . . 0.0 113.766 -178.305 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.514 ' H ' ' HG2' ' A' ' 46' ' ' MET . 0.0 OUTLIER -76.1 -51.9 11.27 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -177.54 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.766 ' HB2' HD21 ' A' ' 28' ' ' LEU . 2.8 mm? -79.67 -0.05 32.35 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.985 -178.693 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.642 HD21 ' CA ' ' A' ' 25' ' ' GLY . 0.2 OUTLIER -66.19 -15.68 63.35 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 121.381 0.61 . . . . 0.0 109.938 177.66 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.549 ' HG2' ' HZ2' ' B' ' 11' ' ' LYS . 0.6 OUTLIER -74.6 17.08 0.22 Allowed 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.572 179.233 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.625 HD11 ' HE3' ' A' ' 68' ' ' LYS . 1.2 tt -84.59 170.35 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.75 179.368 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.624 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 6.9 m-20 -71.56 147.18 47.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.913 0.387 . . . . 0.0 111.721 179.993 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.776 ' HA ' HD23 ' A' ' 55' ' ' LEU . 2.1 t-20 -78.56 -30.84 47.04 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 176.771 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.568 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 0.6 OUTLIER -74.14 -30.46 62.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.395 0.617 . . . . 0.0 109.825 177.234 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.624 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -79.22 -22.67 44.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.364 179.068 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.883 HD13 ' HB2' ' A' ' 27' ' ' ARG . 0.6 OUTLIER -63.53 -47.82 80.07 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.392 179.258 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.661 ' HA ' HD11 ' A' ' 59' ' ' LEU . 2.3 pp -61.29 -41.45 96.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.907 0.384 . . . . 0.0 110.266 179.455 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.0 -13.09 56.96 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.947 178.78 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.583 ' HB2' ' O ' ' A' ' 55' ' ' LEU . 22.4 mmt -76.45 -57.38 3.9 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.473 -179.494 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.881 ' H ' HD13 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -64.3 -10.79 26.33 Favored 'General case' 0 N--CA 1.463 0.176 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.206 179.286 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.54 ' N ' HD22 ' A' ' 59' ' ' LEU . 2.6 tp10 -92.44 -19.12 22.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.276 178.186 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.634 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 1.3 t -122.78 88.48 50.22 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.917 179.369 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -62.5 -31.27 80.42 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.281 1.987 . . . . 0.0 112.202 179.803 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -77.8 -48.44 16.56 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.424 -179.653 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.44 ' O ' ' HB2' ' A' ' 67' ' ' SER . 16.9 m -68.95 -47.73 64.94 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.027 0.442 . . . . 0.0 111.093 -178.935 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.703 ' CD1' HD13 ' A' ' 31' ' ' LEU . 0.6 OUTLIER -57.93 -64.17 1.0 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.749 -0.66 . . . . 0.0 112.01 -178.575 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.625 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.9 OUTLIER -49.03 -32.24 9.03 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.233 -177.084 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.501 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 5.1 m -58.71 -45.27 89.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.163 0.506 . . . . 0.0 110.196 178.233 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.625 ' HE3' HD11 ' A' ' 50' ' ' ILE . 12.3 mtmm -65.48 -64.47 0.85 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.716 179.472 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.517 HG11 HG12 ' A' ' 32' ' ' ILE . 82.8 t -57.52 -20.16 13.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.358 -178.8 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.501 ' HB3' ' O ' ' A' ' 67' ' ' SER . 5.9 t70 -55.92 -51.3 68.11 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 176.468 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.442 ' O ' HG13 ' A' ' 75' ' ' VAL . 1.0 OUTLIER -68.95 -29.17 67.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.827 177.049 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.651 ' O ' HG22 ' A' ' 75' ' ' VAL . . . -58.61 -40.98 84.81 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.32 178.543 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.621 ' HA ' HD13 ' A' ' 43' ' ' ILE . 24.8 t -62.24 -32.22 54.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 177.061 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.408 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -70.52 -38.63 74.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.289 179.394 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.651 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.9 -27.96 36.86 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 CA-C-O 120.995 0.426 . . . . 0.0 110.337 179.556 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.654 ' HB2' HG12 ' A' ' 43' ' ' ILE . 2.8 tm? -71.07 -48.76 50.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.317 178.865 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -60.1 -33.24 71.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.711 179.914 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.89 -20.08 42.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.871 179.138 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 . . . . . 0 C--N 1.331 -0.236 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.879 -179.93 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.167 0 CA-C-O 120.833 0.349 . . . . 0.0 110.923 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.586 HD11 ' O ' ' A' ' 68' ' ' LYS . 35.7 mt -75.98 -79.28 0.1 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.933 -179.97 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 7' ' ' ASN . . . . . 0.511 ' HA ' ' HD3' ' B' ' 8' ' ' PRO . 1.4 t-20 -79.49 127.76 77.33 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.273 -179.36 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 8' ' ' PRO . . . . . 0.511 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 5.9 Cg_exo -79.76 0.43 10.03 Favored 'Trans proline' 0 N--CA 1.459 -0.508 0 C-N-CA 122.744 2.296 . . . . 0.0 112.072 179.502 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 9' ' ' ASN . . . . . 0.538 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 44.0 m-20 -123.51 48.82 1.79 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.877 179.845 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 10' ' ' ALA . . . . . 0.51 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.89 99.13 0.08 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.081 -0.508 . . . . 0.0 112.068 -179.697 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.549 ' HZ2' ' HG2' ' A' ' 49' ' ' GLU . 0.1 OUTLIER -128.0 -178.37 4.49 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 120.776 0.322 . . . . 0.0 110.987 177.432 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -68.61 176.98 2.65 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 121.001 0.429 . . . . 0.0 111.459 -179.55 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 13' ' ' PHE . . . . . 0.421 ' CD1' HD13 ' A' ' 48' ' ' LEU . 1.0 OUTLIER . . . . . 0 C--N 1.333 -0.134 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.13 178.053 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 3.9 mtpp . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.571 0.224 . . . . 0.0 110.464 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.426 ' OH ' ' HG3' ' B' ' 11' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.328 0 CA-C-O 120.831 0.348 . . . . 0.0 110.738 -179.837 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.801 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 13.1 t . . . . . 0 N--CA 1.455 -0.197 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.434 ' HB2' ' OE1' ' A' ' 33' ' ' GLN . . . -59.45 -35.66 74.48 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 176.869 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 26.8 t -72.96 -34.83 66.74 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.849 177.572 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.801 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 4.8 mtm -64.33 -38.72 92.04 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.013 178.189 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.815 HD21 ' HB3' ' A' ' 24' ' ' LEU . 37.3 mt -52.61 -51.29 60.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.099 179.37 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.25 -28.14 68.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.827 177.953 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.66 20.46 16.15 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.77 -178.702 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.697 ' HB1' ' CB ' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.329 -0.307 0 CA-C-O 120.612 0.244 . . . . 0.0 111.12 -179.924 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.697 ' CB ' ' HB1' ' A' ' 15' ' ' ALA . 0.4 OUTLIER . . . . . 0 N--CA 1.453 -0.313 0 CA-C-O 120.603 0.24 . . . . 0.0 110.871 . . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -46.05 -65.73 0.51 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.375 -178.651 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.76 -24.88 37.92 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.265 -178.79 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.426 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 6.6 tp60 -73.62 -77.36 0.11 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.736 0.303 . . . . 0.0 111.648 179.164 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 23' ' ' MET . . . . . 0.728 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -67.24 -97.06 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 112.543 0.571 . . . . 0.0 112.543 -176.375 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.898 HD12 ' HD3' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -62.09 1.07 0.33 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 113.604 0.965 . . . . 0.0 113.604 -175.525 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.695 ' HA3' HD21 ' A' ' 48' ' ' LEU . . . 64.71 -118.47 12.55 Favored Glycine 0 N--CA 1.445 -0.757 0 N-CA-C 108.435 -1.866 . . . . 0.0 108.435 -174.865 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 51' ' ' ASP . 1.8 mp0 -75.78 -68.45 0.57 Allowed 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 168.831 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.898 ' HD3' HD12 ' A' ' 24' ' ' LEU . 8.4 tpt85 -160.24 13.26 0.12 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 113.986 -1.461 . . . . 0.0 107.814 174.59 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.807 HD12 ' HA ' ' A' ' 44' ' ' THR . 1.4 mm? -56.98 -80.23 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 114.568 -1.196 . . . . 0.0 113.627 -173.125 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.8 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -36.14 -49.78 1.67 Allowed Pre-proline 0 CA--C 1.537 0.447 0 N-CA-C 113.626 0.972 . . . . 0.0 113.626 -174.501 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.75 ' HB2' ' NH1' ' A' ' 27' ' ' ARG . 50.6 Cg_exo -58.03 -40.92 73.4 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.209 1.939 . . . . 0.0 113.938 -177.852 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.815 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.86 -47.24 60.37 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 120.343 -0.543 . . . . 0.0 109.906 -179.195 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.546 ' O ' ' HB2' ' A' ' 40' ' ' ALA . 0.3 OUTLIER -74.14 -13.52 15.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.049 178.5 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.634 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 1.5 tt0 -61.46 -42.01 98.1 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 108.55 -0.908 . . . . 0.0 108.55 177.357 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.93 -30.2 70.27 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.077 174.958 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 35' ' ' MET . . . . . 0.526 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 6.7 mtt -100.25 26.11 6.88 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.52 178.364 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.634 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.6 p-80 -63.81 -32.82 8.49 Favored Pre-proline 0 CA--C 1.537 0.445 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -177.726 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.616 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 49.2 Cg_exo -34.56 -35.49 0.1 OUTLIER 'Trans proline' 0 C--N 1.363 1.324 0 C-N-CA 122.316 2.011 . . . . 0.0 112.258 178.897 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.416 ' HB ' ' H ' ' A' ' 39' ' ' LEU . 13.2 m -77.9 -86.11 0.06 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.631 176.547 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.75 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -171.58 65.22 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.302 178.003 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.546 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -49.78 -33.67 17.1 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.452 179.655 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.592 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -50.5 -56.3 13.7 Favored Glycine 0 C--N 1.33 0.201 0 CA-C-N 115.973 -0.558 . . . . 0.0 114.046 -178.294 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.567 ' HE2' ' SD ' ' A' ' 46' ' ' MET . 2.0 tptm -77.54 -38.75 48.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 117.128 0.464 . . . . 0.0 111.952 -177.637 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.673 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 18.3 mt -54.33 -56.21 11.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 121.203 -0.199 . . . . 0.0 111.399 -178.698 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.807 ' HA ' HD12 ' A' ' 28' ' ' LEU . 5.8 t -47.69 -47.7 29.57 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 178.552 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.664 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -49.41 -65.48 2.75 Favored Glycine 0 N--CA 1.451 -0.331 0 CA-C-N 115.656 -0.702 . . . . 0.0 113.621 -179.826 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.656 ' HG3' HD12 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -54.48 -71.23 0.08 Allowed 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 -176.599 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.867 HD23 ' HB2' ' B' ' 7' ' ' ASN . 3.7 mp -66.87 6.17 0.54 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -176.621 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.695 HD21 ' HA3' ' A' ' 25' ' ' GLY . 0.2 OUTLIER -66.84 -1.57 4.1 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.051 0.453 . . . . 0.0 110.539 177.125 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.602 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 1.2 mm-40 -81.99 19.08 1.19 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.579 176.716 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.475 HD11 ' HE3' ' A' ' 68' ' ' LYS . 2.0 tt -82.28 165.1 2.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.175 -178.412 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.453 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 34.5 m-20 -70.42 160.95 31.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.731 -178.751 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.81 ' HA ' HD23 ' A' ' 55' ' ' LEU . 5.1 m120 -87.22 -30.29 21.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.872 177.375 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.6 t -73.86 -29.03 61.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.791 177.714 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.434 ' HG3' ' HB2' ' A' ' 51' ' ' ASP . 4.3 mt-10 -79.65 -29.26 40.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.555 178.804 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.81 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.5 OUTLIER -58.88 -46.49 87.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.976 0.417 . . . . 0.0 110.07 179.395 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.486 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 1.9 tm? -62.62 -41.76 99.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.192 178.623 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.502 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 0.9 OUTLIER -60.88 -34.98 75.45 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.537 178.897 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.57 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -68.91 -43.49 75.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.171 178.758 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.621 HD13 ' NH2' ' A' ' 27' ' ' ARG . 5.4 tp -69.79 -15.1 63.06 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.663 179.49 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.502 ' HG2' ' O ' ' A' ' 57' ' ' HIS . 4.6 pt-20 -102.53 -7.92 21.47 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.009 179.456 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.57 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -125.58 89.02 53.26 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.99 179.65 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -61.69 -32.92 86.94 Favored 'Trans proline' 0 C--N 1.343 0.261 0 C-N-CA 122.266 1.977 . . . . 0.0 111.997 179.538 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -78.05 -48.4 16.19 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.489 -179.683 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.413 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 15.5 m -69.37 -52.18 29.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.956 0.408 . . . . 0.0 111.397 -178.641 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.787 HD11 ' HB3' ' A' ' 31' ' ' LEU . 0.1 OUTLIER -58.1 -57.81 11.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.316 -178.53 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.686 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.5 OUTLIER -51.8 -33.81 37.3 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.492 -178.936 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.589 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 3.9 m -69.71 -35.96 75.5 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.142 0.496 . . . . 0.0 110.094 177.818 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.58 ' HG2' HD21 ' B' ' 6' ' ' LEU . 0.1 OUTLIER -66.09 -56.78 9.79 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.992 178.233 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.541 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 49.1 t -67.7 -15.18 19.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.489 178.585 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.655 ' O ' HG22 ' A' ' 73' ' ' VAL . 10.7 t70 -57.62 -49.42 76.49 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 176.362 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.443 ' O ' HG13 ' A' ' 75' ' ' VAL . 22.0 tt0 -68.34 -26.49 65.62 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.44 176.476 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.673 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -62.43 -43.64 98.33 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.183 179.699 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.655 HG22 ' O ' ' A' ' 70' ' ' ASP . 2.8 m -62.7 -30.58 49.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.941 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -68.99 -36.57 77.98 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.037 178.872 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.65 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -60.21 -32.31 50.32 Favored 'Isoleucine or valine' 0 C--O 1.231 0.121 0 CA-C-O 121.025 0.441 . . . . 0.0 110.175 179.218 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.75 ' HG ' ' HB3' ' A' ' 39' ' ' LEU . 2.6 tm? -71.75 -47.93 50.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.203 178.51 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -55.79 -36.99 68.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.51 179.343 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.49 -15.62 54.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.205 179.527 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.265 0 CA-C-O 120.804 0.335 . . . . 0.0 111.024 -179.618 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 3.6 m120 . . . . . 0 C--O 1.23 0.059 0 CA-C-O 120.814 0.34 . . . . 0.0 111.044 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.58 HD21 ' HG2' ' A' ' 68' ' ' LYS . 41.7 tp -76.41 -76.31 0.17 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.812 179.995 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 7' ' ' ASN . . . . . 0.867 ' HB2' HD23 ' A' ' 47' ' ' LEU . 2.1 t30 -83.4 122.27 77.03 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.74 179.341 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 8' ' ' PRO . . . . . 0.472 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 5.2 Cg_exo -77.61 7.37 3.89 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 122.543 2.162 . . . . 0.0 111.858 179.381 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 9' ' ' ASN . . . . . 0.405 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 4.0 m120 -123.15 38.39 4.2 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.08 -179.593 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.57 89.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.852 -179.266 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.602 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 1.1 mmtp -125.71 129.96 50.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.828 177.952 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 12' ' ' GLU . . . . . 0.526 ' HG2' ' NZ ' ' A' ' 42' ' ' LYS . 6.6 mt-10 -46.63 170.72 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -176.282 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 13' ' ' PHE . . . . . 0.664 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.4 OUTLIER . . . . . 0 CA--C 1.519 -0.218 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.163 178.946 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.893 0.378 . . . . 0.0 110.839 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.996 -179.696 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.761 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 15.1 t . . . . . 0 CA--C 1.522 -0.107 0 N-CA-C 110.257 -0.275 . . . . 0.0 110.257 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.405 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.5 -36.25 75.69 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 176.566 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 16.8 t -67.77 -34.83 77.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.668 177.399 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.761 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 9.6 mtm -64.26 -37.34 87.12 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.006 177.696 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.791 HD11 ' HB3' ' A' ' 24' ' ' LEU . 2.0 mp -51.9 -47.67 64.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.096 179.364 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.26 -34.33 77.76 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.23 178.644 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.2 m -100.36 21.95 12.34 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.631 -178.63 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.691 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.012 179.568 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.691 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 1.2 tp10 . . . . . 0 CA--C 1.527 0.067 0 CA-C-O 120.667 0.27 . . . . 0.0 111.287 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.432 ' O ' HD23 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -51.02 -59.84 3.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.299 -179.92 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.469 ' H ' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -55.65 -21.47 18.16 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.514 -178.122 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.482 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 17.4 tt0 -73.2 -79.24 0.08 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.989 0.423 . . . . 0.0 111.512 179.206 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 23' ' ' MET . . . . . 0.669 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.32 -94.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.795 -0.638 . . . . 0.0 112.685 -176.935 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.791 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -62.02 -0.81 0.55 Allowed 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.434 0.902 . . . . 0.0 113.434 -175.363 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.533 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.86 -117.18 9.96 Favored Glycine 0 N--CA 1.444 -0.815 0 N-CA-C 108.474 -1.85 . . . . 0.0 108.474 -174.853 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.471 ' O ' HD13 ' A' ' 55' ' ' LEU . 0.7 OUTLIER -76.08 -68.73 0.55 Allowed 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 169.247 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.806 ' HG2' HD12 ' A' ' 59' ' ' LEU . 7.8 tpt180 -160.07 12.84 0.12 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 114.47 -1.241 . . . . 0.0 108.424 175.673 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.568 HD12 HD11 ' A' ' 32' ' ' ILE . 4.0 mm? -57.02 -78.89 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.622 -1.172 . . . . 0.0 113.623 -173.043 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.737 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -36.6 -48.92 1.85 Allowed Pre-proline 0 CA--C 1.537 0.452 0 N-CA-C 113.48 0.919 . . . . 0.0 113.48 -175.062 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.585 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 52.4 Cg_exo -56.62 -43.42 55.26 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.293 1.995 . . . . 0.0 113.719 -178.279 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.767 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.61 -46.08 64.06 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.169 0.509 . . . . 0.0 110.124 -178.242 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.681 HG21 HD12 ' A' ' 43' ' ' ILE . 0.3 OUTLIER -77.72 -12.38 13.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.453 179.105 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.625 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 11.2 tp60 -62.65 -38.67 91.19 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 176.654 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.73 -31.51 70.64 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.053 -0.976 . . . . 0.0 108.967 174.482 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 35' ' ' MET . . . . . 0.485 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 7.6 mtt -100.27 27.43 5.68 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.35 178.023 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.814 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 1.7 p-80 -63.63 -32.88 8.78 Favored Pre-proline 0 CA--C 1.536 0.423 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -177.869 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.814 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 3.4 Cg_exo -35.3 -32.82 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.284 0 C-N-CA 122.687 2.258 . . . . 0.0 112.211 179.488 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.402 ' N ' ' O ' ' A' ' 36' ' ' HIS . 45.4 m -78.09 -86.83 0.06 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.101 -0.499 . . . . 0.0 109.811 176.637 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.668 ' O ' HG13 ' A' ' 43' ' ' ILE . 6.1 tp -171.47 56.08 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.512 178.175 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.478 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -39.87 -34.7 0.29 Allowed 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -179.865 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.606 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.58 -58.96 6.96 Favored Glycine 0 CA--C 1.519 0.289 0 CA-C-N 116.058 -0.519 . . . . 0.0 114.021 -179.049 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.945 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.3 OUTLIER -77.48 -30.35 53.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 117.068 0.434 . . . . 0.0 111.574 -178.356 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.681 HD12 HG21 ' A' ' 32' ' ' ILE . 5.1 mt -57.19 -58.21 6.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.116 -179.271 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.599 HG21 ' CD2' ' A' ' 29' ' ' PHE . 5.3 t -47.72 -45.89 29.23 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.984 0.421 . . . . 0.0 110.526 178.661 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.744 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -50.86 -66.94 2.16 Favored Glycine 0 N--CA 1.452 -0.279 0 CA-C-N 115.511 -0.768 . . . . 0.0 113.709 -179.28 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.737 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.37 -49.99 70.86 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 117.047 0.423 . . . . 0.0 111.527 -177.744 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.48 HD22 ' N ' ' A' ' 47' ' ' LEU . 2.9 mm? -76.49 3.33 11.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.542 -178.389 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.541 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.29 -10.29 41.08 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.991 0.424 . . . . 0.0 110.55 179.545 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.414 ' HG3' ' O ' ' B' ' 9' ' ' ASN . 3.1 mm-40 -82.39 19.71 1.19 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.508 178.438 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.424 HG23 ' O ' ' A' ' 51' ' ' ASP . 1.1 tt -83.57 164.32 2.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.024 -179.409 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.424 ' O ' HG23 ' A' ' 50' ' ' ILE . 1.0 OUTLIER -70.97 157.95 37.33 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.498 -179.404 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.862 ' HA ' HD23 ' A' ' 55' ' ' LEU . 14.0 m-80 -86.1 -29.81 23.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.148 178.14 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -73.32 -33.77 65.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.232 0.539 . . . . 0.0 109.579 177.706 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.425 ' O ' ' SD ' ' A' ' 58' ' ' MET . 3.4 mt-10 -75.73 -29.25 58.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.688 178.945 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.862 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -58.46 -46.8 85.85 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.877 0.37 . . . . 0.0 110.213 -179.922 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.643 ' HA ' HD11 ' A' ' 59' ' ' LEU . 1.6 tt -59.5 -46.01 90.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.759 179.342 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.591 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 1.5 m80 -62.12 -16.91 55.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.548 -179.519 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.561 ' HB3' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -75.88 -56.53 4.59 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 -178.462 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.859 ' H ' HD13 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -64.38 -12.0 38.38 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.269 -0.573 . . . . 0.0 110.678 179.953 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.594 ' N ' HD22 ' A' ' 59' ' ' LEU . 2.4 pt-20 -98.7 -12.29 21.15 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.899 179.283 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.537 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.3 OUTLIER -122.96 92.04 49.42 Favored Pre-proline 0 C--N 1.332 -0.186 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.079 179.886 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.435 ' O ' ' HB2' ' A' ' 66' ' ' ARG . 36.0 Cg_endo -64.49 -31.29 61.24 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.337 2.025 . . . . 0.0 112.009 179.409 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.62 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.63 -47.14 17.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.267 179.895 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.62 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 15.1 m -70.95 -55.55 8.12 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.503 -178.564 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.767 HD21 HD13 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -58.19 -61.52 2.5 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.613 -178.184 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.661 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -50.26 -31.21 13.55 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.94 -178.043 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.522 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.6 OUTLIER -68.17 -40.76 82.2 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.1 0.476 . . . . 0.0 110.294 177.949 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.493 ' HD3' ' CE ' ' A' ' 58' ' ' MET . 30.0 mtpt -65.86 -59.38 3.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.566 179.299 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.527 ' CG1' HG23 ' A' ' 32' ' ' ILE . 44.8 t -60.53 -20.99 22.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.486 179.86 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.598 ' O ' HG22 ' A' ' 73' ' ' VAL . 28.3 t0 -55.61 -48.87 74.18 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.219 -0.659 . . . . 0.0 109.219 176.55 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.594 ' HB3' HD13 ' B' ' 6' ' ' LEU . 1.1 tt0 -68.98 -26.69 65.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.936 176.845 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.675 ' O ' HG22 ' A' ' 75' ' ' VAL . . . -62.35 -53.36 56.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.022 179.871 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.643 ' HA ' HD13 ' A' ' 43' ' ' ILE . 2.8 m -54.23 -29.4 19.34 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 177.356 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.514 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -70.78 -36.43 73.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.466 179.856 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.675 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.5 m -56.23 -28.37 25.6 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 178.673 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.945 HD11 ' HB3' ' A' ' 42' ' ' LYS . 1.6 mm? -71.83 -51.63 21.5 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.126 176.846 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -52.81 -35.16 56.55 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.854 178.507 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -82.29 -21.46 36.15 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.185 178.173 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 9.4 t-80 . . . . . 0 N--CA 1.462 0.157 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.886 -179.373 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.456 -0.147 0 CA-C-O 120.784 0.326 . . . . 0.0 110.46 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.594 HD13 ' HB3' ' A' ' 71' ' ' GLU . 1.4 tp -75.23 -81.59 0.07 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.782 179.272 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 7' ' ' ASN . . . . . 0.447 ' HB2' ' CD1' ' A' ' 47' ' ' LEU . 1.2 t-20 -79.83 120.16 79.08 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.193 179.883 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -76.01 3.09 6.42 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.196 1.93 . . . . 0.0 111.67 178.415 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 9' ' ' ASN . . . . . 0.511 ' HB3' ' NZ ' ' B' ' 11' ' ' LYS . 5.4 m120 -123.3 48.09 1.89 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.477 179.354 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 10' ' ' ALA . . . . . 0.737 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -59.44 96.83 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.801 -179.087 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.511 ' NZ ' ' HB3' ' B' ' 9' ' ' ASN . 8.3 mttp -125.19 133.78 52.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.076 178.189 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 12' ' ' GLU . . . . . 0.62 ' HG2' ' HE3' ' A' ' 42' ' ' LYS . 44.9 mt-10 -48.29 165.43 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.033 0.444 . . . . 0.0 111.982 -178.591 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 13' ' ' PHE . . . . . 0.744 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.8 OUTLIER . . . . . 0 C--N 1.33 -0.246 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.435 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.891 0.377 . . . . 0.0 110.998 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.412 ' HD1' ' HA ' ' B' ' 19' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.823 -179.771 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.744 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 7.2 t . . . . . 0 N--CA 1.456 -0.126 0 CA-C-O 120.64 0.257 . . . . 0.0 110.484 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.5 -36.89 76.92 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 176.948 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.0 t -68.93 -35.5 76.87 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.599 177.318 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.744 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.3 mtm -64.42 -36.05 82.9 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.972 177.506 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.727 ' HA ' ' HE2' ' A' ' 23' ' ' MET . 3.1 mp -52.15 -48.18 65.03 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.113 179.185 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.02 -33.86 76.78 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.15 178.846 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.7 m -101.5 25.53 8.3 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.715 -178.811 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.509 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.271 179.556 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.543 ' HG3' ' HB3' ' A' ' 22' ' ' GLN . 1.4 tp10 . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.653 0.263 . . . . 0.0 111.043 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.516 ' O ' HD12 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -59.23 -49.27 78.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.011 0.434 . . . . 0.0 110.764 -179.723 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.524 ' HB3' ' HE3' ' A' ' 21' ' ' LYS . 0.3 OUTLIER -56.82 -22.46 36.63 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.159 -179.303 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.543 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 12.5 tt0 -72.96 -76.5 0.12 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.946 0.403 . . . . 0.0 111.413 179.728 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 23' ' ' MET . . . . . 0.727 ' HE2' ' HA ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.73 -95.76 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -176.854 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.634 HD23 HD11 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -62.14 1.64 0.29 Allowed 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -175.602 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.55 -116.49 9.09 Favored Glycine 0 N--CA 1.444 -0.816 0 N-CA-C 108.226 -1.95 . . . . 0.0 108.226 -174.376 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.583 ' HB3' ' HB2' ' A' ' 55' ' ' LEU . 1.9 mp0 -75.75 -69.18 0.51 Allowed 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 168.814 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.94 ' HG3' HD21 ' A' ' 31' ' ' LEU . 23.3 tpt180 -160.25 8.9 0.1 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.132 -1.394 . . . . 0.0 107.458 175.416 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 1.002 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -58.28 -74.82 0.06 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.398 -1.274 . . . . 0.0 113.879 -172.259 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.63 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -38.54 -47.0 3.18 Favored Pre-proline 0 CA--C 1.536 0.441 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 -175.229 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.483 ' HD2' ' O ' ' A' ' 27' ' ' ARG . 52.2 Cg_exo -57.5 -42.04 65.41 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.172 1.915 . . . . 0.0 113.398 -179.126 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.94 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.79 -43.26 69.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.18 0.514 . . . . 0.0 109.833 -179.067 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.679 HG21 HD12 ' A' ' 43' ' ' ILE . 0.4 OUTLIER -77.01 -15.57 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.06 177.901 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.649 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 4.9 tt0 -63.17 -35.08 79.11 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 177.101 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.26 -30.19 65.99 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.011 -0.995 . . . . 0.0 108.651 174.676 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 35' ' ' MET . . . . . 0.51 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 7.7 mtt -100.12 24.66 8.35 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.881 177.539 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.649 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -64.65 -31.46 5.68 Favored Pre-proline 0 CA--C 1.535 0.377 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.694 -178.213 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.555 ' CD ' ' N ' ' A' ' 36' ' ' HIS . 64.5 Cg_exo -38.61 -27.65 0.12 Allowed 'Trans proline' 0 C--N 1.363 1.313 0 C-N-CA 121.98 1.786 . . . . 0.0 111.9 178.244 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.858 HG22 HD12 ' A' ' 39' ' ' LEU . 13.6 m -77.66 -95.32 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 175.8 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.858 HD12 HG22 ' A' ' 38' ' ' THR . 2.2 mp -154.59 42.34 0.49 Allowed 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 177.662 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -42.19 105.99 0.05 Allowed 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 178.065 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.63 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . 170.49 -63.75 0.17 Allowed Glycine 0 N--CA 1.447 -0.576 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.883 -176.846 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.698 ' HE3' ' HG2' ' B' ' 12' ' ' GLU . 0.0 OUTLIER -77.86 -30.6 50.99 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.745 0.307 . . . . 0.0 110.658 178.773 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.776 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 60.0 mt -54.05 -62.22 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.244 -179.711 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 44' ' ' THR . . . . . 1.002 ' HA ' HD22 ' A' ' 28' ' ' LEU . 9.9 t -47.1 -41.14 16.69 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.185 -179.471 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.704 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -53.3 -63.71 4.83 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.854 178.769 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.755 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.63 -51.06 68.47 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.686 0.279 . . . . 0.0 111.476 -178.548 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.494 ' HB2' HD21 ' A' ' 28' ' ' LEU . 2.3 mm? -78.67 4.8 12.64 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.772 -178.044 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.688 ' HB3' ' HD2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -66.25 -11.74 52.08 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.919 0.39 . . . . 0.0 110.62 179.371 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.443 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 3.2 mm-40 -74.64 13.5 0.61 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.265 177.605 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.525 HD11 ' HE3' ' A' ' 68' ' ' LYS . 0.1 OUTLIER -84.87 156.84 3.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.008 -179.66 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.457 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 1.1 m-20 -71.36 156.36 39.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.744 -179.817 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.822 ' HA ' HD23 ' A' ' 55' ' ' LEU . 2.0 m-80 -82.41 -22.8 35.21 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 121.266 0.555 . . . . 0.0 109.598 176.423 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -74.61 -37.33 62.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.325 0.583 . . . . 0.0 109.794 176.807 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.07 -22.57 58.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.304 179.348 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.822 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.4 OUTLIER -63.04 -48.17 79.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.882 178.56 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.526 ' O ' ' HG3' ' A' ' 60' ' ' GLU . 53.1 tp -55.28 -43.79 75.08 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.347 179.01 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -58.41 -41.17 84.34 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.056 179.226 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.521 ' HB3' ' HG ' ' A' ' 65' ' ' LEU . 24.4 mmt -60.12 -36.69 78.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.058 179.687 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.772 HD12 ' NE ' ' A' ' 27' ' ' ARG . 8.3 tt -70.9 -19.83 62.56 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.286 -179.19 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.526 ' HG3' ' O ' ' A' ' 56' ' ' LEU . 13.7 mt-10 -106.53 -3.72 20.52 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 -178.607 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.539 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.3 OUTLIER -122.52 83.08 47.44 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 120.602 0.239 . . . . 0.0 111.213 -179.447 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -59.94 -31.93 94.38 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.312 2.008 . . . . 0.0 111.945 179.237 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -78.09 -49.01 14.76 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.498 -179.793 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 47.4 m -70.58 -52.78 19.22 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.889 0.376 . . . . 0.0 111.439 -178.63 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.889 HD21 HD13 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -57.93 -62.24 1.95 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.26 -178.704 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.627 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.5 OUTLIER -50.71 -35.77 32.9 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.157 -177.831 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.61 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 4.2 m -67.96 -36.21 79.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.292 0.568 . . . . 0.0 110.049 178.127 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.525 ' HE3' HD11 ' A' ' 50' ' ' ILE . 9.7 ttpt -66.12 -57.67 7.15 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.11 178.556 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.621 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 42.0 t -65.21 -15.64 18.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.373 178.572 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.61 ' HB3' ' O ' ' A' ' 67' ' ' SER . 9.4 t70 -57.3 -48.98 77.55 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 176.313 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.558 ' HB3' HD13 ' B' ' 6' ' ' LEU . 4.5 tt0 -68.6 -21.97 64.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.673 176.515 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.776 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -63.95 -51.17 65.62 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.817 179.597 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.589 HG22 ' O ' ' A' ' 70' ' ' ASP . 2.6 m -56.15 -29.17 26.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 176.851 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.523 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -70.86 -32.47 69.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.055 178.64 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.717 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.6 m -57.06 -33.48 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 178.515 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.732 HD13 ' HB2' ' A' ' 39' ' ' LEU . 39.0 mt -66.56 -48.3 70.1 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 175.96 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 17.1 mm100 -54.72 -36.79 65.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.315 178.916 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.89 -20.69 38.32 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.159 178.57 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 . . . . . 0 C--N 1.332 -0.165 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.902 -179.381 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' B' B ' 5' ' ' ASN . . . . . 0.432 ' HB3' ' HG2' ' A' ' 71' ' ' GLU . 0.3 OUTLIER . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.792 0.33 . . . . 0.0 111.029 . . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.558 HD13 ' HB3' ' A' ' 71' ' ' GLU . 1.4 tp -74.45 -77.85 0.11 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.014 -179.75 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 7' ' ' ASN . . . . . 0.481 ' HA ' ' HD3' ' B' ' 8' ' ' PRO . 1.6 t-20 -83.71 138.33 40.88 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.026 179.867 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 8' ' ' PRO . . . . . 0.481 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 5.6 Cg_exo -79.86 -7.78 14.44 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.75 2.3 . . . . 0.0 111.928 179.234 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 9' ' ' ASN . . . . . 0.579 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 64.8 m-20 -123.38 56.31 1.2 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.185 -179.76 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 10' ' ' ALA . . . . . 0.755 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.8 98.94 0.08 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.707 179.507 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.579 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.0 OUTLIER -124.99 156.47 38.05 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.471 178.446 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' B' B ' 12' ' ' GLU . . . . . 0.698 ' HG2' ' HE3' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -56.25 166.49 0.82 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.764 0.316 . . . . 0.0 111.416 -179.656 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' B' B ' 13' ' ' PHE . . . . . 0.704 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.1 t80 . . . . . 0 N--CA 1.463 0.176 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.681 179.84 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 18' ' ' LYS . . . . . 0.536 ' HG2' ' ND2' ' A' ' 52' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.812 0.339 . . . . 0.0 110.849 . . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.688 ' HD2' ' HB3' ' A' ' 48' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.936 -179.86 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.741 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 5.8 t . . . . . 0 CA--C 1.523 -0.091 0 CA-C-O 120.536 0.208 . . . . 0.0 110.886 . . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.23 -33.66 71.28 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 177.707 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -75.09 -34.98 61.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.94 177.574 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.741 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 9.0 mtm -64.42 -36.78 85.28 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.898 177.869 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.621 HD11 ' HB3' ' A' ' 24' ' ' LEU . 1.2 mp -52.59 -56.28 16.39 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.906 178.626 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.29 -25.27 66.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.881 178.202 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.6 m -101.61 23.7 10.83 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.834 -178.534 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.724 ' HB1' ' HB2' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.753 -0.203 . . . . 0.0 111.161 179.545 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.724 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 1.9 mm-40 . . . . . 0 N--CA 1.448 -0.575 0 CA-C-O 120.514 0.197 . . . . 0.0 110.886 . . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.496 ' O ' HD12 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -46.43 -61.0 2.0 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.223 -177.73 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.538 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -56.32 -25.02 47.44 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.293 -179.32 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.495 ' OE1' ' HG3' ' A' ' 23' ' ' MET . 2.9 tt0 -73.44 -75.56 0.14 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.844 0.354 . . . . 0.0 111.52 179.468 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 23' ' ' MET . . . . . 0.617 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.15 -96.58 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -176.309 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.621 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -61.96 0.73 0.35 Allowed 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 -175.532 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 65.0 -117.29 10.11 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 108.421 -1.872 . . . . 0.0 108.421 -174.322 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.433 ' O ' HD13 ' A' ' 24' ' ' LEU . 1.2 mp0 -75.91 -68.54 0.57 Allowed 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 169.401 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.971 ' HG2' HD22 ' A' ' 59' ' ' LEU . 1.7 tpt180 -160.06 11.75 0.12 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.216 175.537 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.485 ' O ' HG13 ' A' ' 32' ' ' ILE . 4.1 mm? -57.2 -78.45 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.608 -1.178 . . . . 0.0 113.49 -173.302 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.716 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -35.05 -48.33 1.04 Allowed Pre-proline 0 CA--C 1.539 0.521 0 N-CA-C 113.642 0.978 . . . . 0.0 113.642 -175.517 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.545 ' HG2' ' HD2' ' A' ' 27' ' ' ARG . 46.8 Cg_exo -59.69 -42.16 49.11 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 122.367 2.045 . . . . 0.0 113.736 -178.204 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.784 HD22 ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.61 -44.54 67.06 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 121.131 0.491 . . . . 0.0 109.97 -178.474 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.529 HG23 ' CG1' ' A' ' 69' ' ' VAL . 0.2 OUTLIER -76.9 -13.0 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.968 178.179 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.612 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 49.6 tp60 -62.33 -37.47 85.72 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 176.75 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.47 -32.5 71.46 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.139 174.749 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 35' ' ' MET . . . . . 0.54 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 7.0 mtt -100.13 28.75 4.68 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.203 177.85 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.612 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.2 OUTLIER -63.16 -32.15 8.1 Favored Pre-proline 0 CA--C 1.535 0.402 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -177.429 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.567 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 60.0 Cg_exo -36.65 -32.85 0.13 Allowed 'Trans proline' 0 C--N 1.362 1.275 0 C-N-CA 122.083 1.855 . . . . 0.0 112.27 179.23 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.511 HG22 HD12 ' A' ' 76' ' ' LEU . 86.6 m -78.26 -88.08 0.05 Allowed 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.8 176.836 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.681 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 0.1 OUTLIER -171.35 61.17 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.447 178.203 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.476 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -44.99 -34.24 2.36 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.848 0.356 . . . . 0.0 111.616 179.661 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.639 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -50.94 -58.16 9.88 Favored Glycine 0 C--N 1.33 0.243 0 CA-C-N 115.989 -0.551 . . . . 0.0 113.867 -178.995 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.494 ' H ' HD12 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -77.86 -34.35 51.74 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -177.867 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.65 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 36.1 mt -55.98 -55.43 18.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.715 -0.22 . . . . 0.0 111.481 -179.008 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.566 HG21 ' CD2' ' A' ' 29' ' ' PHE . 6.1 t -47.56 -44.18 25.91 Favored 'General case' 0 CA--C 1.522 -0.119 0 CA-C-O 121.006 0.432 . . . . 0.0 110.135 178.637 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.803 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -49.65 -65.39 2.85 Favored Glycine 0 N--CA 1.448 -0.501 0 CA-C-N 115.312 -0.858 . . . . 0.0 113.464 -179.862 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.615 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.33 -50.72 68.88 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -177.276 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.5 HD22 ' N ' ' A' ' 47' ' ' LEU . 2.9 mm? -79.06 6.2 10.04 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -177.917 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.559 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.21 -7.65 19.55 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.984 0.421 . . . . 0.0 110.622 179.195 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.436 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 3.3 mt-10 -81.96 16.8 1.75 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.664 178.437 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -83.16 158.82 3.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.816 -179.514 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -70.59 160.05 33.23 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.02 0.438 . . . . 0.0 111.838 -178.089 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.943 ' HA ' HD23 ' A' ' 55' ' ' LEU . 4.9 m120 -83.67 -31.39 26.17 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.448 178.738 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.1 t -74.01 -34.27 64.1 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.387 0.613 . . . . 0.0 109.523 177.516 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.442 ' OE2' ' HE3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -75.58 -28.65 59.03 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.645 179.367 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.943 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -59.34 -47.07 86.79 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 120.923 0.392 . . . . 0.0 110.003 179.124 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.684 ' HA ' HD21 ' A' ' 59' ' ' LEU . 2.2 tm? -56.33 -48.04 77.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.926 -179.844 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.45 ' O ' ' HB2' ' A' ' 61' ' ' SER . 15.4 t60 -58.05 -24.67 59.33 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.918 -179.119 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.631 ' HE2' ' HA ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -73.86 -58.17 3.48 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -177.542 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.971 HD22 ' HG2' ' A' ' 27' ' ' ARG . 2.2 pt? -65.59 -6.03 9.9 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.962 -179.024 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.542 ' HG3' HD13 ' A' ' 56' ' ' LEU . 13.4 mm-40 -106.68 -10.86 15.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.679 177.455 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.572 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.5 OUTLIER -122.5 97.83 44.3 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.137 179.75 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -64.06 -30.53 66.07 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.201 1.934 . . . . 0.0 112.028 179.07 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -78.22 -51.26 10.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.599 -179.7 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.444 ' HB3' ' HB3' ' A' ' 61' ' ' SER . 33.2 t -69.07 -44.65 72.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.686 -178.033 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.784 ' HG ' HD22 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -69.86 -62.14 1.5 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.986 -177.136 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.667 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -51.15 -29.28 13.13 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.962 -177.646 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.476 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.4 OUTLIER -69.59 -39.53 77.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.138 0.494 . . . . 0.0 110.233 178.013 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.442 ' HE3' ' OE2' ' A' ' 54' ' ' GLU . 5.0 mtmm -65.49 -61.05 2.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.236 178.862 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.529 ' CG1' HG23 ' A' ' 32' ' ' ILE . 53.0 t -61.78 -20.95 24.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.942 -179.416 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.603 ' O ' HG22 ' A' ' 73' ' ' VAL . 16.5 t70 -54.63 -51.76 64.39 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 176.458 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.497 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 0.5 OUTLIER -69.23 -26.3 64.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.017 177.003 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.686 ' O ' HG22 ' A' ' 75' ' ' VAL . . . -61.17 -48.2 82.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.04 179.952 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.603 HG22 ' O ' ' A' ' 70' ' ' ASP . 2.6 m -58.48 -31.58 43.66 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 177.541 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.497 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -68.16 -37.92 81.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.145 178.952 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.686 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -60.61 -31.17 48.38 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.217 0 CA-C-O 120.919 0.39 . . . . 0.0 110.225 179.511 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.681 ' HG ' ' HB3' ' A' ' 39' ' ' LEU . 2.3 tm? -71.41 -49.54 40.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.215 178.803 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 9.7 mm100 -57.62 -37.64 73.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.457 179.214 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.29 -21.78 39.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.905 -0.588 . . . . 0.0 111.067 179.293 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 11.9 t-80 . . . . . 0 C--N 1.331 -0.237 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.025 -179.534 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 11.9 m120 . . . . . 0 C--O 1.232 0.169 0 CA-C-O 120.86 0.362 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.432 HD12 ' HA ' ' B' ' 6' ' ' LEU . 7.5 tp -68.87 -77.53 0.08 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.112 178.182 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 7' ' ' ASN . . . . . 0.463 ' HA ' ' HD3' ' B' ' 8' ' ' PRO . 1.4 t-20 -92.08 127.6 48.72 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.327 177.768 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 8' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 6.6 Cg_exo -73.77 -2.12 11.76 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.281 1.987 . . . . 0.0 112.177 -179.717 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 8.3 m-20 -123.76 40.31 3.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.042 -179.774 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 10' ' ' ALA . . . . . 0.615 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -53.1 92.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.508 -179.383 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.497 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -121.37 136.23 54.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.946 179.125 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -47.67 168.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -177.905 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 13' ' ' PHE . . . . . 0.803 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.6 OUTLIER . . . . . 0 C--O 1.233 0.185 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.783 179.171 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 18' ' ' LYS . . . . . 0.538 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 1.8 mppt? . . . . . 0 C--O 1.231 0.12 0 CA-C-O 121.012 0.434 . . . . 0.0 110.556 . . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.497 ' CE2' ' HG2' ' B' ' 11' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.101 -178.922 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.761 HG21 ' HB3' ' A' ' 29' ' ' PHE . 9.9 t . . . . . 0 CA--C 1.522 -0.122 0 CA-C-O 120.637 0.256 . . . . 0.0 110.559 . . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.509 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.18 -36.57 75.56 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 177.175 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 35.2 t -71.4 -34.19 70.15 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.625 177.003 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.736 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 5.3 mtm -64.32 -34.31 77.84 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 177.347 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.633 HD11 ' HB3' ' A' ' 24' ' ' LEU . 3.4 mp -52.54 -52.61 53.97 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.902 178.481 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.09 -25.51 67.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.895 178.414 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.6 p -101.93 13.23 35.37 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.846 -178.676 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.777 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 CA--C 1.534 0.339 0 CA-C-O 120.528 0.204 . . . . 0.0 111.29 -179.871 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.777 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.205 0 CA-C-O 120.912 0.387 . . . . 0.0 110.676 . . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -47.07 -67.27 0.29 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.521 -179.14 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.59 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.79 -21.21 18.12 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.814 -177.706 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.59 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 10.3 tt0 -73.52 -78.32 0.1 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.006 0.431 . . . . 0.0 111.254 179.177 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 23' ' ' MET . . . . . 0.587 ' HE2' ' HB3' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -69.25 -95.99 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -176.909 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.649 ' HB2' ' HG2' ' A' ' 30' ' ' PRO . 0.3 OUTLIER -61.63 -1.32 0.56 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -175.323 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.597 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.38 -117.41 10.61 Favored Glycine 0 CA--C 1.505 -0.569 0 N-CA-C 108.262 -1.935 . . . . 0.0 108.262 -174.6 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.477 ' O ' HD22 ' A' ' 55' ' ' LEU . 0.6 OUTLIER -76.45 -67.59 0.68 Allowed 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 107.143 -1.428 . . . . 0.0 107.143 168.049 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.69 ' HB2' HD13 ' A' ' 55' ' ' LEU . 1.6 tpt180 -159.71 10.54 0.12 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 114.364 -1.289 . . . . 0.0 108.614 175.302 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.513 HD12 ' HA ' ' A' ' 44' ' ' THR . 3.8 mm? -56.91 -84.84 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.655 -1.157 . . . . 0.0 113.929 -172.924 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.761 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -31.14 -51.09 0.43 Allowed Pre-proline 0 CA--C 1.539 0.535 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -174.833 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.649 ' HG2' ' HB2' ' A' ' 24' ' ' LEU . 54.1 Cg_exo -56.43 -42.75 62.37 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 122.238 1.959 . . . . 0.0 113.875 -178.178 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.662 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.12 -44.06 66.38 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.112 0.482 . . . . 0.0 110.375 -178.232 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.73 HG21 HD12 ' A' ' 43' ' ' ILE . 0.0 OUTLIER -72.55 -20.64 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.708 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.127 179.254 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 62.8 tp60 -62.79 -31.45 72.43 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 175.684 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.33 -20.14 55.34 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 114.99 -1.004 . . . . 0.0 109.984 176.942 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 35' ' ' MET . . . . . 0.602 ' HG3' ' HA ' ' A' ' 32' ' ' ILE . 2.5 mtt -98.49 7.06 46.65 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.117 178.679 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -77.29 163.46 64.45 Favored Pre-proline 0 N--CA 1.447 -0.621 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.427 -179.75 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -100.85 90.05 0.08 OUTLIER 'Cis proline' 0 C--N 1.353 0.769 0 C-N-CA 124.535 -1.027 . . . . 0.0 113.49 4.078 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 6.5 m -98.99 -70.36 0.73 Allowed 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 176.163 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 1.035 HD23 HD12 ' A' ' 76' ' ' LEU . 2.9 tp -171.76 28.62 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.157 176.887 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -33.6 -38.96 0.05 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.046 -179.272 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.584 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -52.26 -53.0 33.3 Favored Glycine 0 C--N 1.33 0.238 0 C-N-CA 121.052 -0.594 . . . . 0.0 113.048 179.61 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.95 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -78.16 -34.14 49.9 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 122.676 -0.308 . . . . 0.0 111.427 -179.725 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.829 HD13 ' HA ' ' A' ' 73' ' ' VAL . 1.8 mt -54.14 -57.98 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-O 120.583 0.23 . . . . 0.0 110.789 179.979 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.513 ' HA ' HD12 ' A' ' 28' ' ' LEU . 10.0 t -47.76 -46.03 29.73 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.078 178.558 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.581 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -50.15 -66.49 2.32 Favored Glycine 0 N--CA 1.449 -0.462 0 CA-C-N 115.608 -0.724 . . . . 0.0 113.214 179.838 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.505 ' HB2' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.47 -51.68 66.14 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -177.648 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.486 HD12 ' HB2' ' B' ' 7' ' ' ASN . 2.8 mm? -79.35 8.33 6.33 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -177.975 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.581 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.13 -6.82 14.57 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.08 0.467 . . . . 0.0 110.334 178.676 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.471 ' OE2' ' HB3' ' B' ' 11' ' ' LYS . 3.3 mt-10 -81.66 16.06 1.91 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.607 178.698 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.84 HD11 ' NZ ' ' A' ' 68' ' ' LYS . 0.9 OUTLIER -83.18 160.25 3.58 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.633 -179.729 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.529 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 34.4 m-20 -70.99 154.98 41.36 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.97 0.414 . . . . 0.0 112.036 -178.16 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.833 ' HA ' HD23 ' A' ' 55' ' ' LEU . 2.4 t30 -82.99 -31.08 27.72 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.034 177.995 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.2 t -73.97 -33.46 63.87 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.344 0.592 . . . . 0.0 109.477 177.592 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.529 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -75.38 -27.82 59.25 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.467 179.074 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.833 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -59.64 -47.82 84.08 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.189 179.432 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.449 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 12.2 tp -56.54 -46.27 80.76 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.623 179.361 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -59.75 -32.67 70.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.28 179.882 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.539 ' SD ' ' HE2' ' A' ' 68' ' ' LYS . 32.0 mmt -60.87 -51.61 68.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.432 -179.4 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.585 ' HG ' ' NH2' ' A' ' 27' ' ' ARG . 0.2 OUTLIER -61.61 -22.23 65.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.081 -179.057 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 56' ' ' LEU . 2.2 mt-10 -99.75 -3.64 32.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.8 179.954 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.585 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 16.0 m -122.72 80.64 48.57 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.52 179.617 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.37 -35.69 95.97 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.147 1.898 . . . . 0.0 111.996 179.85 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.579 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.67 -45.19 21.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.718 -179.466 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.579 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 7.0 m -70.47 -51.98 25.27 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.952 0.406 . . . . 0.0 111.33 -178.079 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.626 ' HG ' ' N ' ' A' ' 66' ' ' ARG . 0.3 OUTLIER -58.12 -61.06 2.83 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.672 -178.755 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.626 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 1.1 ttp180 -48.39 -33.33 8.95 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.221 -177.436 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.443 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 8.2 t -61.67 -44.23 97.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.118 0.485 . . . . 0.0 110.277 178.307 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.84 ' NZ ' HD11 ' A' ' 50' ' ' ILE . 13.6 mtpp -65.92 -63.03 1.18 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.806 179.451 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.593 ' CG1' HG23 ' A' ' 32' ' ' ILE . 55.2 t -58.77 -19.45 14.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.089 -179.496 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.59 ' O ' HG22 ' A' ' 73' ' ' VAL . 20.4 t70 -58.19 -48.89 78.91 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 175.709 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.47 ' HB3' HD13 ' B' ' 6' ' ' LEU . 3.5 tt0 -69.03 -27.23 65.48 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.817 176.603 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.598 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -60.31 -54.39 46.31 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.178 179.485 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.829 ' HA ' HD13 ' A' ' 43' ' ' ILE . 3.3 m -55.08 -29.62 22.65 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 177.932 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.432 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -73.57 -36.37 65.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.618 179.794 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.569 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.1 m -56.26 -31.17 31.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 N-CA-C 109.713 -0.476 . . . . 0.0 109.713 179.493 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 1.035 HD12 HD23 ' A' ' 39' ' ' LEU . 4.4 mm? -72.21 -48.69 41.08 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.861 176.552 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 34.9 mm-40 -50.82 -34.38 27.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.316 177.906 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -82.18 -29.7 31.35 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.55 176.911 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 16.4 t-80 . . . . . 0 N--CA 1.462 0.169 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.979 -179.913 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 3.0 m120 . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.875 0.369 . . . . 0.0 110.433 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.47 HD13 ' HB3' ' A' ' 71' ' ' GLU . 1.9 tp -64.8 -83.19 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.472 178.949 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 7' ' ' ASN . . . . . 0.486 ' HB2' HD12 ' A' ' 47' ' ' LEU . 0.7 OUTLIER -82.47 113.06 41.67 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.441 178.301 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -66.41 -5.05 11.84 Favored 'Trans proline' 0 N--CA 1.463 -0.296 0 C-N-CA 122.122 1.882 . . . . 0.0 112.242 -179.728 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 69.0 m-20 -123.74 38.52 4.17 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.465 179.139 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 10' ' ' ALA . . . . . 0.505 ' HB1' ' HB2' ' A' ' 46' ' ' MET . . . -53.91 94.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.87 -178.641 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.584 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -115.01 131.59 56.87 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.839 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' B' B ' 12' ' ' GLU . . . . . 0.539 ' HG2' ' HD2' ' A' ' 42' ' ' LYS . 6.7 mt-10 -50.0 178.97 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -177.204 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 13' ' ' PHE . . . . . 0.46 ' CE1' ' HG ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.519 -0.218 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.853 179.725 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.152 0 CA-C-O 121.075 0.464 . . . . 0.0 110.974 . . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.584 ' CE2' ' HG2' ' B' ' 11' ' ' LYS . 2.1 t80 . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.067 -179.511 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.77 HG21 ' HB3' ' A' ' 29' ' ' PHE . 9.8 t . . . . . 0 N--CA 1.456 -0.151 0 CA-C-O 120.685 0.279 . . . . 0.0 110.435 . . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.44 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.22 -36.23 75.05 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 177.068 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 5.4 t -68.98 -35.74 77.06 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.746 177.101 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.753 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 5.4 mtm -64.39 -35.92 82.46 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.943 177.769 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.813 HD11 ' HB3' ' A' ' 24' ' ' LEU . 4.2 mp -52.31 -48.48 65.37 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.07 178.921 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.97 -30.17 70.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.836 178.312 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.9 p -101.71 21.56 14.26 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.716 -179.012 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.622 ' HB1' ' CB ' ' A' ' 19' ' ' GLU . . . . . . . . 0 CA--C 1.532 0.277 0 CA-C-O 120.555 0.217 . . . . 0.0 111.319 179.875 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.622 ' CB ' ' HB1' ' A' ' 15' ' ' ALA . 2.1 mm-40 . . . . . 0 N--CA 1.449 -0.483 0 CA-C-O 120.604 0.24 . . . . 0.0 110.727 . . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.415 ' O ' HD23 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -46.04 -70.1 0.11 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.122 -179.078 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.515 ' H ' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -55.6 -18.59 7.99 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.651 -177.668 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.541 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 10.8 tp60 -73.95 -79.22 0.09 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.909 0.385 . . . . 0.0 111.457 178.223 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 23' ' ' MET . . . . . 0.698 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.17 -94.9 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.984 -0.553 . . . . 0.0 112.412 -176.775 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.813 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -59.45 0.52 0.12 Allowed 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -176.588 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.556 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.36 -118.85 13.69 Favored Glycine 0 CA--C 1.501 -0.84 0 N-CA-C 107.979 -2.048 . . . . 0.0 107.979 -174.384 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.542 ' CD ' HG22 ' A' ' 50' ' ' ILE . 29.0 mt-10 -77.26 -66.01 0.88 Allowed 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 167.659 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.825 ' HB2' HD13 ' A' ' 55' ' ' LEU . 2.5 tpt180 -160.22 9.51 0.1 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.095 -1.411 . . . . 0.0 108.472 174.76 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.94 HD12 ' HA ' ' A' ' 44' ' ' THR . 3.6 mm? -56.99 -80.42 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.732 -1.122 . . . . 0.0 113.681 -172.978 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.77 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -34.82 -48.71 1.01 Allowed Pre-proline 0 CA--C 1.538 0.505 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -174.445 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.665 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 50.5 Cg_exo -57.95 -42.85 54.1 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.15 1.9 . . . . 0.0 113.573 -178.972 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.604 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.86 -47.4 53.26 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.664 -178.328 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.639 ' HA ' ' HG3' ' A' ' 35' ' ' MET . 0.0 OUTLIER -69.76 -18.22 21.91 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 C-N-CA 120.614 -0.434 . . . . 0.0 109.938 178.86 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.478 ' HB3' ' O ' ' A' ' 30' ' ' PRO . 36.4 tp60 -62.88 -34.14 76.76 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 174.136 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -74.16 -19.12 60.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 114.775 -1.102 . . . . 0.0 110.128 176.816 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 35' ' ' MET . . . . . 0.639 ' HG3' ' HA ' ' A' ' 32' ' ' ILE . 0.1 OUTLIER -98.66 -3.42 36.08 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.892 178.22 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.435 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -62.51 166.05 7.98 Favored Pre-proline 0 N--CA 1.448 -0.568 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.247 -179.951 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.405 ' HA ' ' CB ' ' A' ' 36' ' ' HIS . 69.6 Cg_endo -103.7 61.3 0.62 Allowed 'Cis proline' 0 N--CA 1.455 -0.747 0 C-N-CA 124.69 -0.962 . . . . 0.0 113.959 5.158 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 52.7 m -77.04 -73.8 0.28 Allowed 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 176.793 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.584 HD13 HD11 ' A' ' 76' ' ' LEU . 0.2 OUTLIER -171.95 49.5 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.848 176.428 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.504 ' CB ' ' HB ' ' A' ' 32' ' ' ILE . . . -41.47 -34.63 0.57 Allowed 'General case' 0 N--CA 1.462 0.13 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.582 179.907 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -54.3 -71.99 0.62 Allowed Glycine 0 N--CA 1.452 -0.28 0 CA-C-N 116.083 -0.508 . . . . 0.0 113.692 -179.207 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.541 ' O ' ' HG2' ' A' ' 46' ' ' MET . 0.0 OUTLIER -57.57 -41.85 81.91 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -177.074 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.641 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 22.7 mt -53.31 -57.4 4.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 121.079 0.466 . . . . 0.0 110.195 179.262 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.94 ' HA ' HD12 ' A' ' 28' ' ' LEU . 1.3 m -47.64 -45.78 28.19 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.247 177.475 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.744 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -51.25 -60.7 6.92 Favored Glycine 0 N--CA 1.445 -0.71 0 CA-C-N 115.06 -0.973 . . . . 0.0 113.231 -179.623 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.622 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -54.41 -59.47 4.65 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.746 0.307 . . . . 0.0 111.779 -177.473 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.793 HD23 ' HB2' ' B' ' 7' ' ' ASN . 1.1 mp -79.9 18.23 0.84 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.162 0.431 . . . . 0.0 112.162 -176.742 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.599 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.01 -6.94 14.42 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.301 0.572 . . . . 0.0 109.582 175.659 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.515 ' OE1' ' HB3' ' B' ' 9' ' ' ASN . 2.6 mt-10 -93.24 25.35 3.37 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.756 179.462 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.542 HG22 ' CD ' ' A' ' 26' ' ' GLU . 3.5 tt -83.0 176.23 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.782 -179.72 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.745 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 7.0 m-20 -73.53 124.47 25.94 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.705 0.261 . . . . 0.0 111.705 179.441 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.673 ' HA ' HD23 ' A' ' 55' ' ' LEU . 7.2 t30 -66.14 -30.54 71.05 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.448 0.642 . . . . 0.0 109.722 177.521 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.6 m -73.31 -33.19 65.03 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.838 177.612 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.745 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 3.9 mm-40 -76.96 -24.4 52.31 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.449 178.81 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.825 HD13 ' HB2' ' A' ' 27' ' ' ARG . 0.6 OUTLIER -59.08 -47.93 83.46 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 179.515 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.44 HD22 ' HA ' ' A' ' 56' ' ' LEU . 0.3 OUTLIER -59.45 -42.33 91.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.779 178.174 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.531 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 26.6 m-70 -69.27 -19.03 63.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.243 179.321 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.551 ' HG2' ' O ' ' A' ' 54' ' ' GLU . 23.8 mmt -68.66 -58.97 3.48 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.053 -179.576 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.698 HD13 ' NE ' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -61.51 -21.02 63.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.103 -179.577 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.531 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 0.6 OUTLIER -91.62 -9.57 43.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.085 179.817 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.552 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.5 OUTLIER -122.92 85.25 50.41 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.799 179.696 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_exo -59.88 -33.52 95.85 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.398 2.065 . . . . 0.0 112.292 -179.666 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.636 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.22 -45.8 22.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.297 -179.395 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.636 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 10.7 m -70.62 -54.16 13.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.83 0.348 . . . . 0.0 111.328 -178.695 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.632 ' HG ' ' N ' ' A' ' 66' ' ' ARG . 0.3 OUTLIER -57.82 -61.99 2.13 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.866 -178.286 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.632 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -48.53 -35.29 12.92 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.055 -177.256 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.15 -44.01 97.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.155 0.502 . . . . 0.0 110.154 178.45 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.514 ' HZ1' HD11 ' A' ' 50' ' ' ILE . 29.4 mtpt -66.3 -62.21 1.6 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.114 179.619 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.514 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 45.4 t -59.8 -21.29 21.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.187 -178.871 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.598 ' O ' HG22 ' A' ' 73' ' ' VAL . 18.5 t70 -58.34 -48.52 80.31 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 176.412 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.513 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 0.8 OUTLIER -69.04 -25.61 64.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.597 176.557 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.641 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -62.2 -53.15 59.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.015 -179.908 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.598 HG22 ' O ' ' A' ' 70' ' ' ASP . 11.1 m -57.41 -26.28 26.0 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 177.684 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.513 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -73.18 -36.84 66.64 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.187 178.618 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.564 HG13 ' HA ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.04 -37.65 62.71 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.147 0 CA-C-O 120.896 0.379 . . . . 0.0 110.051 179.458 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.584 HD11 HD13 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -71.8 -43.11 66.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.081 177.961 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 54.7 mm-40 -52.85 -38.51 61.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.732 178.624 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.69 -26.02 35.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.302 177.151 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 18.2 t60 . . . . . 0 C--N 1.331 -0.196 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.039 -179.886 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 . . . . . 0 C--O 1.232 0.166 0 CA-C-O 120.773 0.321 . . . . 0.0 110.896 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.452 HD11 ' HG2' ' A' ' 68' ' ' LYS . 0.4 OUTLIER -62.7 -80.89 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.622 179.532 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' B' B ' 7' ' ' ASN . . . . . 0.793 ' HB2' HD23 ' A' ' 47' ' ' LEU . 1.4 t-20 -87.02 117.43 68.62 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.831 179.193 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -73.77 6.37 2.89 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.314 2.01 . . . . 0.0 111.957 179.619 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 9' ' ' ASN . . . . . 0.515 ' HB3' ' OE1' ' A' ' 49' ' ' GLU . 71.5 m-20 -123.08 38.73 4.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.83 179.92 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 10' ' ' ALA . . . . . 0.622 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -59.37 88.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.961 -179.189 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.471 ' HG3' ' CD ' ' A' ' 49' ' ' GLU . 12.8 mttp -112.73 123.36 50.12 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 177.553 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -47.19 171.11 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -176.668 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 13' ' ' PHE . . . . . 0.744 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.2 OUTLIER . . . . . 0 CA--C 1.521 -0.15 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.714 179.529 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 33.2 mttt . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.9 0.381 . . . . 0.0 110.571 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.327 -0.374 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.047 -179.166 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.798 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 11.7 t . . . . . 0 CA--C 1.52 -0.181 0 CA-C-O 120.654 0.264 . . . . 0.0 110.339 . . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.68 -36.4 74.13 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 177.107 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.2 -36.26 71.84 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.785 177.341 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.798 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.4 mtm -64.45 -38.51 91.28 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.383 178.527 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.587 ' HA ' ' HE2' ' A' ' 23' ' ' MET . 50.9 mt -52.45 -49.39 64.71 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.16 179.516 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.41 -32.38 73.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.184 178.233 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.78 27.72 6.23 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.81 -178.502 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.745 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.695 -0.229 . . . . 0.0 111.202 179.696 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.745 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 2.7 tp10 . . . . . 0 N--CA 1.46 0.047 0 CA-C-O 120.611 0.243 . . . . 0.0 111.346 . . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.484 ' O ' HD12 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -54.41 -56.95 13.45 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.494 -178.86 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.602 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -55.94 -20.38 15.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.642 -177.963 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.434 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 12.0 tt0 -73.0 -79.04 0.08 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.956 0.408 . . . . 0.0 111.453 179.533 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 23' ' ' MET . . . . . 0.601 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.93 -94.32 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -176.684 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.601 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -61.46 3.34 0.13 Allowed 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 -174.705 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.74 -117.78 11.18 Favored Glycine 0 N--CA 1.444 -0.778 0 N-CA-C 108.214 -1.954 . . . . 0.0 108.214 -174.475 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 51' ' ' ASP . 1.3 mp0 -76.07 -67.55 0.67 Allowed 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 168.987 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.715 ' NE ' HD22 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -160.5 8.97 0.09 Allowed 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 114.258 -1.337 . . . . 0.0 108.086 176.466 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.904 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.3 OUTLIER -59.66 -73.85 0.08 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.316 -1.311 . . . . 0.0 114.051 -173.889 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.579 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -35.27 -48.45 1.15 Allowed Pre-proline 0 CA--C 1.541 0.596 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -175.42 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.599 ' HB2' ' NH1' ' A' ' 27' ' ' ARG . 45.1 Cg_exo -59.65 -41.96 51.24 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.372 2.048 . . . . 0.0 113.387 -178.601 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.946 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.33 -47.29 61.73 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 120.478 -0.489 . . . . 0.0 109.87 -178.957 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.488 HG13 ' O ' ' A' ' 28' ' ' LEU . 0.3 OUTLIER -73.3 -13.69 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.652 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.096 178.505 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.623 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 4.3 tp60 -61.33 -41.7 97.46 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 177.531 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.25 -28.8 67.53 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.124 175.13 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 35' ' ' MET . . . . . 0.558 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 5.5 mtt -102.01 27.42 6.6 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.345 178.393 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.623 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -63.79 -31.59 6.62 Favored Pre-proline 0 CA--C 1.537 0.468 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -177.083 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.601 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 54.9 Cg_exo -34.63 -34.32 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.255 0 C-N-CA 122.25 1.967 . . . . 0.0 112.406 179.33 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.608 HG22 HD12 ' A' ' 76' ' ' LEU . 23.5 m -78.6 -88.08 0.06 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.79 176.638 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.436 ' CB ' ' HG ' ' A' ' 76' ' ' LEU . 0.1 OUTLIER -171.34 62.47 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.408 178.14 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.478 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -43.81 -41.14 4.84 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.653 179.586 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.579 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -50.87 -53.61 25.68 Favored Glycine 0 C--N 1.33 0.22 0 CA-C-N 116.02 -0.536 . . . . 0.0 113.807 -178.692 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.508 ' HE2' ' SD ' ' A' ' 46' ' ' MET . 0.4 OUTLIER -77.43 -39.09 48.08 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.826 0.313 . . . . 0.0 111.764 -177.969 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.621 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 31.2 mt -53.86 -56.97 6.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.5 0.19 . . . . 0.0 110.972 -179.19 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.904 ' HA ' HD22 ' A' ' 28' ' ' LEU . 10.0 t -50.76 -42.26 57.54 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.811 0.339 . . . . 0.0 110.418 178.808 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.657 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -50.62 -67.93 1.69 Allowed Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 115.953 -0.567 . . . . 0.0 112.981 -179.761 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.508 ' SD ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.29 -46.37 76.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.789 0.295 . . . . 0.0 111.664 -178.723 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.418 HD22 ' N ' ' A' ' 47' ' ' LEU . 3.2 mm? -80.18 6.52 11.52 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 111.537 0.199 . . . . 0.0 111.537 -179.166 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.657 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.1 OUTLIER -65.81 -10.74 40.46 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.064 0.459 . . . . 0.0 110.372 179.558 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.494 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.5 mm-40 -79.23 18.43 0.68 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.415 177.831 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.629 HD11 ' HE3' ' A' ' 68' ' ' LYS . 1.3 tt -83.3 160.75 3.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.175 -179.381 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.471 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 17.7 m-20 -71.15 160.29 33.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.938 -178.837 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.734 ' HA ' HD23 ' A' ' 55' ' ' LEU . 5.8 m120 -87.69 -29.61 20.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.995 177.349 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 67.9 m -72.72 -33.05 66.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.897 178.12 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.467 ' HG3' ' HB2' ' A' ' 51' ' ' ASP . 14.8 mt-10 -75.83 -28.05 58.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.612 179.041 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.734 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.4 OUTLIER -59.64 -48.81 80.18 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.303 179.597 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.481 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 1.1 tm? -61.43 -37.0 81.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.409 179.322 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.518 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 4.8 m-70 -64.52 -35.98 82.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.259 178.428 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.586 ' HB3' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -66.01 -41.94 90.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.411 178.702 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.715 HD22 ' NE ' ' A' ' 27' ' ' ARG . 3.4 tp -69.69 -14.67 62.92 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.884 179.475 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.518 ' HG2' ' O ' ' A' ' 57' ' ' HIS . 5.0 pt-20 -106.77 -3.26 20.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.818 179.282 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.572 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 4.6 m -124.39 84.74 56.29 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.968 -179.548 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -60.35 -35.03 92.8 Favored 'Trans proline' 0 N--CA 1.464 -0.255 0 C-N-CA 122.214 1.943 . . . . 0.0 112.094 179.517 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.46 ' O ' ' HB2' ' A' ' 67' ' ' SER . 0.0 OUTLIER -78.81 -44.89 22.11 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.768 -179.419 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.551 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 12.8 m -74.22 -50.44 19.11 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.827 0.346 . . . . 0.0 111.539 -177.996 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.946 HD21 HD13 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -58.16 -64.96 0.73 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.118 -179.027 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.683 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.6 OUTLIER -49.19 -33.87 13.38 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.793 0.33 . . . . 0.0 110.793 -178.801 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.595 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.6 OUTLIER -69.58 -37.03 76.8 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 121.057 0.456 . . . . 0.0 110.148 177.933 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.629 ' HE3' HD11 ' A' ' 50' ' ' ILE . 9.4 ttpt -65.76 -57.86 7.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.081 178.491 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.532 HG21 ' CD1' ' A' ' 31' ' ' LEU . 46.9 t -63.48 -19.28 23.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.781 178.925 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.667 ' O ' HG22 ' A' ' 73' ' ' VAL . 9.1 t70 -55.89 -49.59 72.99 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 176.708 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.474 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 0.7 OUTLIER -69.02 -25.74 64.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.768 176.731 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.621 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -62.15 -44.25 97.03 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.937 179.758 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.667 HG22 ' O ' ' A' ' 70' ' ' ASP . 2.5 m -61.06 -31.71 50.71 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 177.419 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.474 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -66.1 -38.5 88.38 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.039 178.946 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.587 HG22 ' O ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -58.72 -31.97 45.55 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.095 0 CA-C-O 121.001 0.429 . . . . 0.0 110.124 179.262 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.608 HD12 HG22 ' A' ' 38' ' ' THR . 2.4 tm? -70.97 -46.77 61.77 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.943 178.177 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -52.86 -37.05 59.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.405 179.212 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.21 -22.61 38.69 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.844 178.819 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 0.442 ' HB3' ' O ' ' A' ' 76' ' ' LEU . 20.4 t-80 . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.714 179.598 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.752 0.31 . . . . 0.0 110.886 . . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 5.7 mt -69.66 -78.59 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.683 179.706 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 7' ' ' ASN . . . . . 0.483 ' HA ' ' HD3' ' B' ' 8' ' ' PRO . 1.5 t-20 -82.1 127.95 69.82 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.951 179.494 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 8' ' ' PRO . . . . . 0.483 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 2.9 Cg_exo -76.96 -6.06 16.4 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.525 2.15 . . . . 0.0 111.948 179.249 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -123.12 56.65 1.16 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.945 179.963 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.26 96.73 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.567 179.955 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.494 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 0.7 OUTLIER -122.21 131.21 53.82 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.499 178.785 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -49.31 171.83 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.068 0.461 . . . . 0.0 112.087 -178.787 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 13' ' ' PHE . . . . . 0.465 ' CE1' ' HG ' ' A' ' 48' ' ' LEU . 0.3 OUTLIER . . . . . 0 CA--C 1.518 -0.287 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.03 179.498 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 18' ' ' LYS . . . . . 0.602 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.944 0.402 . . . . 0.0 110.815 . . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.893 -179.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.21 0 N-CA-C 112.487 -0.245 . . . . 0.0 112.487 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -75.41 -20.65 15.87 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.56 2.173 . . . . 0.0 112.278 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.4 mp -86.18 45.28 1.21 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.916 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -87.42 4.18 86.15 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.36 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.548 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.1 OUTLIER -77.4 -49.95 2.18 Favored Pre-proline 0 C--N 1.329 -0.297 0 N-CA-C 111.481 0.178 . . . . 0.0 111.481 179.989 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.548 ' HD2' ' N ' ' A' ' 5' ' ' SER . 44.4 Cg_endo -68.06 -158.73 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 122.106 1.871 . . . . 0.0 112.257 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.478 ' HB3' ' OE1' ' A' ' 33' ' ' GLN . 0.4 OUTLIER -91.21 -179.42 5.42 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.009 -179.68 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.829 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 9.0 t -87.94 -29.27 20.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.355 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.42 -37.77 78.93 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 176.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 42.5 t -69.44 -35.08 75.33 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.683 177.053 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.829 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.2 mtm -64.41 -38.61 91.65 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.117 178.223 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.754 HD21 ' HB3' ' A' ' 24' ' ' LEU . 46.1 mt -52.42 -49.31 64.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.211 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.55 -30.53 70.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.146 178.057 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.5 p -101.44 17.92 21.46 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.763 -178.473 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.613 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -138.19 116.46 9.5 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.067 -179.818 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.425 ' HD2' ' OE2' ' A' ' 19' ' ' GLU . 53.3 Cg_exo -53.17 167.77 0.69 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.678 2.252 . . . . 0.0 112.285 179.755 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -56.71 -33.59 94.2 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.367 2.044 . . . . 0.0 112.423 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 12.8 mp0 -71.77 -12.32 61.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.908 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.613 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.4 OUTLIER -85.19 14.17 5.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.023 -179.891 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.52 -63.56 1.1 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.13 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.617 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -55.97 -19.55 12.87 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.643 -178.239 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.551 ' N ' ' HE2' ' A' ' 21' ' ' LYS . 24.1 tt0 -73.61 -80.48 0.07 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.085 0.469 . . . . 0.0 111.465 179.039 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.681 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.8 -95.24 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.816 -176.807 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.853 HD12 ' HD3' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -60.47 -1.37 0.35 Allowed 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -175.522 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.589 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.76 -116.04 8.52 Favored Glycine 0 N--CA 1.446 -0.68 0 N-CA-C 108.423 -1.871 . . . . 0.0 108.423 -174.653 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.97 -69.4 0.5 Allowed 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 168.765 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.853 ' HD3' HD12 ' A' ' 24' ' ' LEU . 0.5 OUTLIER -160.06 9.99 0.11 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.226 -1.352 . . . . 0.0 108.002 175.007 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.998 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.41 -74.88 0.06 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.146 -1.388 . . . . 0.0 114.012 -173.456 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.6 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -34.54 -49.2 0.97 Allowed Pre-proline 0 CA--C 1.537 0.465 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -175.754 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.599 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 52.1 Cg_exo -57.68 -44.68 39.14 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.297 1.998 . . . . 0.0 113.424 -179.025 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.595 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.75 -44.07 67.54 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.178 -178.371 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.832 HD11 HD23 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -76.19 -12.72 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.13 178.021 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.633 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 3.2 tp60 -62.58 -37.41 86.09 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 176.37 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.78 -32.39 72.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.25 -0.887 . . . . 0.0 108.934 174.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.512 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 7.3 mtt -100.34 27.96 5.33 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.221 177.842 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.633 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 2.1 p-80 -63.77 -32.61 8.2 Favored Pre-proline 0 CA--C 1.536 0.442 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -177.328 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.544 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 62.0 Cg_exo -38.24 -28.57 0.12 Allowed 'Trans proline' 0 C--N 1.362 1.244 0 C-N-CA 122.224 1.949 . . . . 0.0 112.229 179.412 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.732 HG21 HG13 ' A' ' 73' ' ' VAL . 7.1 m -78.08 -86.54 0.06 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.874 176.705 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.497 ' O ' HG13 ' A' ' 43' ' ' ILE . 2.6 tp -171.46 49.7 0.02 OUTLIER 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.065 178.409 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.439 ' CA ' HG13 ' A' ' 43' ' ' ILE . . . -32.5 -46.5 0.14 Allowed 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 112.262 0.468 . . . . 0.0 112.262 -178.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.6 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -44.72 -59.12 4.45 Favored Glycine 0 C--N 1.33 0.216 0 CA-C-N 116.132 -0.485 . . . . 0.0 114.127 -178.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.739 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.5 OUTLIER -76.66 -27.08 55.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 117.032 0.416 . . . . 0.0 111.798 -177.646 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.775 HD12 HG21 ' A' ' 32' ' ' ILE . 0.9 OUTLIER -57.83 -56.34 16.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.735 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.998 ' HA ' HD22 ' A' ' 28' ' ' LEU . 12.3 t -50.54 -40.55 52.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.47 179.239 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.657 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -50.5 -68.41 1.46 Allowed Glycine 0 N--CA 1.451 -0.304 0 CA-C-N 115.913 -0.585 . . . . 0.0 113.28 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.655 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.61 -49.34 73.05 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 122.809 -0.23 . . . . 0.0 111.493 -178.365 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.535 HD12 ' HB2' ' B' ' 7' ' ' ASN . 2.3 mm? -79.94 9.62 5.17 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -178.366 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.627 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.96 -22.01 66.45 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.946 0.403 . . . . 0.0 110.606 179.276 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.565 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 3.4 mm-40 -74.63 21.72 0.11 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.062 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.47 ' H ' ' C ' ' A' ' 48' ' ' LEU . 2.6 tt -83.24 165.1 2.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.795 179.584 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.489 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 20.4 m-20 -70.79 156.38 39.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.862 0.363 . . . . 0.0 111.573 -179.109 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.864 ' HA ' HD23 ' A' ' 55' ' ' LEU . 15.6 m-80 -88.9 -28.24 20.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.778 177.391 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.4 t -74.03 -30.18 62.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.664 177.396 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.489 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 4.9 mm-40 -80.11 -26.9 39.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.592 178.765 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.864 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.8 OUTLIER -59.16 -46.61 87.93 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.872 0.368 . . . . 0.0 110.052 179.636 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.438 HD22 ' HA ' ' A' ' 56' ' ' LEU . 0.2 OUTLIER -64.4 -41.31 96.72 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.468 179.19 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.523 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 7.0 t60 -64.5 -30.39 71.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.267 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.477 ' HB3' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -65.89 -45.24 82.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.869 -179.667 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.631 HD23 ' CG ' ' A' ' 27' ' ' ARG . 0.1 OUTLIER -66.38 -18.49 65.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.787 179.398 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.523 ' HG2' ' O ' ' A' ' 57' ' ' HIS . 4.1 pt-20 -100.14 -8.05 24.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.234 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.646 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.9 OUTLIER -125.38 88.1 54.68 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.946 179.737 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -60.06 -33.07 95.55 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.278 1.985 . . . . 0.0 112.23 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -78.0 -49.34 14.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.59 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 68.3 m -69.69 -32.24 70.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.888 0.375 . . . . 0.0 111.336 -178.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.646 ' HB3' ' O ' ' A' ' 61' ' ' SER . 1.1 tp -73.34 -65.23 0.84 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.598 -178.512 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.599 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -49.02 -29.67 5.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.186 -177.839 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.547 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.2 OUTLIER -65.43 -43.79 89.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.101 0.477 . . . . 0.0 110.286 178.292 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.452 ' HE3' HD11 ' A' ' 50' ' ' ILE . 22.1 mtpt -65.86 -55.86 14.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.626 179.208 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.507 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 53.2 t -65.01 -19.74 26.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.662 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.547 ' HB3' ' O ' ' A' ' 67' ' ' SER . 7.2 t70 -55.83 -48.52 75.3 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 176.574 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.48 ' O ' HG13 ' A' ' 75' ' ' VAL . 13.7 tt0 -67.06 -33.97 76.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.637 176.745 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.684 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -55.55 -44.73 77.06 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.651 178.647 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.732 HG13 HG21 ' A' ' 38' ' ' THR . 11.7 t -60.0 -32.49 50.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.936 177.818 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.43 -36.38 65.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.629 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.605 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.15 -28.84 35.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 120.922 0.391 . . . . 0.0 110.268 179.968 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.739 HD11 ' HB3' ' A' ' 42' ' ' LYS . 3.4 mm? -71.91 -54.32 10.39 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.802 178.566 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 25.5 mm100 -51.3 -36.63 43.35 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.469 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.48 -26.14 35.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.873 178.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.523 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 60.6 t60 -63.74 -45.77 88.35 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.21 -179.423 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -83.26 -12.76 56.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.092 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.84 -53.64 6.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.451 -179.52 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 23.8 mttp -77.04 -6.98 54.82 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.268 -179.131 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.523 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 6.5 tt0 -90.0 -39.46 12.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.113 -179.775 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -79.68 -27.56 40.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.2 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -84.11 30.69 0.51 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.239 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -81.1 -78.07 0.19 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.038 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -94.81 -17.13 22.39 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.985 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -87.24 53.77 2.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.166 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.0 p -103.38 117.5 48.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.939 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -104.48 -39.41 6.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.935 -179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -73.44 155.69 39.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.966 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.11 166.74 22.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.152 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 26.7 p -92.7 -178.17 4.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.837 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -77.2 149.36 35.64 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.479 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 5.4 m -91.58 148.19 36.84 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 120.547 0.213 . . . . 0.0 110.956 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -79.03 61.01 8.03 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.572 2.181 . . . . 0.0 112.44 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.2 p -87.98 107.78 18.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.951 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 5.8 t . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.075 -0.964 . . . . 0.0 111.068 -179.93 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 5.6 m . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.803 0.335 . . . . 0.0 111.041 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 3.5 t -97.8 98.0 6.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.989 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 10.6 mttm -91.69 132.06 36.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.91 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 4' ' ' SER . . . . . 0.506 ' HB2' ' HB2' ' B' ' 10' ' ' ALA . 5.9 t -88.24 175.56 7.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.955 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 -113.91 -48.34 2.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.944 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.51 ' HB3' HD11 ' A' ' 47' ' ' LEU . 17.6 tp -68.94 -76.53 0.09 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.777 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 7' ' ' ASN . . . . . 0.535 ' HB2' HD12 ' A' ' 47' ' ' LEU . 1.7 t-20 -88.55 135.96 31.89 Favored Pre-proline 0 C--N 1.331 -0.197 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.856 179.38 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 5.7 Cg_exo -79.68 -3.65 13.01 Favored 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 122.73 2.287 . . . . 0.0 111.974 179.245 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 9' ' ' ASN . . . . . 0.481 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 9.6 m-20 -123.16 51.09 1.48 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.174 -179.691 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 10' ' ' ALA . . . . . 0.655 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.23 93.69 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.746 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.565 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 3.0 mttp -124.94 154.08 41.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.376 178.521 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -54.51 166.12 0.48 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.808 0.337 . . . . 0.0 111.316 -179.341 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 13' ' ' PHE . . . . . 0.657 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.1 t80 -88.37 107.85 19.05 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.761 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 14' ' ' VAL . . . . . 0.421 ' HA ' ' HD2' ' B' ' 15' ' ' PRO . 1.1 m -111.21 90.6 11.91 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.552 178.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 15' ' ' PRO . . . . . 0.421 ' HD2' ' HA ' ' B' ' 14' ' ' VAL . 15.6 Cg_endo -55.82 -167.67 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.917 2.411 . . . . 0.0 112.921 -179.284 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 16' ' ' GLY . . . . . 0.444 ' C ' ' HD2' ' A' ' 21' ' ' LYS . . . 85.09 -50.0 4.32 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.906 -0.664 . . . . 0.0 112.307 -179.405 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 7.1 m -116.31 151.04 18.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.69 0.281 . . . . 0.0 111.013 178.515 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.617 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 0.2 OUTLIER -70.94 89.29 0.78 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.79 179.622 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -67.4 125.1 25.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.957 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 93.35 15.93 48.81 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.549 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -100.07 166.98 10.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.806 0.336 . . . . 0.0 110.917 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 3.9 mt . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.214 -0.898 . . . . 0.0 111.091 -179.968 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.168 0 N-CA-C 112.479 -0.248 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -55.28 -39.27 91.91 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.624 2.216 . . . . 0.0 112.189 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.46 -27.33 61.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.915 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.79 96.95 2.26 Favored Glycine 0 C--N 1.33 0.224 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.489 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.599 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.1 OUTLIER -80.59 -50.44 1.07 Allowed Pre-proline 0 CA--C 1.534 0.332 0 N-CA-C 111.537 0.199 . . . . 0.0 111.537 -179.96 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.599 ' HD2' ' N ' ' A' ' 5' ' ' SER . 19.3 Cg_endo -58.44 110.48 0.66 Allowed 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 122.224 1.95 . . . . 0.0 112.249 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 5.6 mt -94.49 -59.76 1.87 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.83 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.851 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 9.7 t -88.0 -32.49 18.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.404 -179.805 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.99 -34.49 71.9 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 177.046 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.82 -35.72 70.01 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.608 177.151 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.851 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 3.6 mtm -64.6 -38.09 89.83 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.189 177.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.654 HD21 ' HB3' ' A' ' 24' ' ' LEU . 68.8 mt -52.69 -50.78 62.64 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.003 179.463 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.5 -26.6 67.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.715 177.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.43 18.12 20.94 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.645 -178.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.814 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -134.38 59.18 35.05 Favored Pre-proline 0 CA--C 1.532 0.283 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.994 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.494 ' HD3' ' N ' ' A' ' 15' ' ' ALA . 52.8 Cg_exo -56.39 -49.71 14.22 Favored 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 122.79 2.327 . . . . 0.0 114.058 -178.156 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.465 ' HD2' ' N ' ' A' ' 16' ' ' PRO . 52.7 Cg_endo -68.76 -162.08 0.08 OUTLIER 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 121.946 1.764 . . . . 0.0 112.543 -178.758 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -73.53 69.69 1.24 Allowed 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.62 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.814 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.9 OUTLIER -104.48 8.23 35.53 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.029 -179.242 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.576 HE22 ' HG2' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -46.86 -61.37 1.89 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.286 -178.96 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.576 ' HG2' HE22 ' A' ' 20' ' ' GLN . 0.0 OUTLIER -56.11 -25.11 44.57 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.685 -178.282 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.762 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 0.7 OUTLIER -73.26 -77.04 0.11 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.834 0.35 . . . . 0.0 111.627 179.921 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.639 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -68.99 -95.91 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -176.483 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.654 ' HB3' HD21 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -61.9 -1.8 0.73 Allowed 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -175.515 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.533 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.8 -116.64 9.21 Favored Glycine 0 N--CA 1.446 -0.688 0 N-CA-C 108.535 -1.826 . . . . 0.0 108.535 -174.798 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.499 ' O ' HD13 ' A' ' 55' ' ' LEU . 0.9 OUTLIER -76.13 -69.97 0.47 Allowed 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 169.052 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.772 ' HG3' HD21 ' A' ' 31' ' ' LEU . 7.4 tpt180 -159.96 13.52 0.13 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.4 -1.273 . . . . 0.0 108.044 175.566 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.495 HD12 HD11 ' A' ' 32' ' ' ILE . 4.1 mm? -57.3 -78.85 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.406 -1.27 . . . . 0.0 113.574 -173.439 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.835 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -36.05 -49.58 1.61 Allowed Pre-proline 0 CA--C 1.537 0.469 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -175.676 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.58 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 55.0 Cg_exo -55.29 -43.05 62.45 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.25 1.966 . . . . 0.0 113.611 -178.407 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.869 HD22 ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -71.18 -48.44 51.67 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.065 0.459 . . . . 0.0 110.336 -178.493 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.495 HD11 HD12 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -71.87 -14.26 17.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.091 178.672 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.631 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.3 OUTLIER -62.24 -40.77 97.29 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 176.893 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.38 -30.51 71.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.166 174.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.534 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 5.7 mtt -103.15 27.2 7.4 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.394 178.48 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.631 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 2.4 p-80 -62.92 -32.55 9.05 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -177.486 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.579 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 57.2 Cg_exo -36.0 -32.94 0.11 Allowed 'Trans proline' 0 C--N 1.362 1.266 0 C-N-CA 122.221 1.948 . . . . 0.0 112.199 179.014 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 62.6 m -78.18 -88.38 0.05 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.83 176.507 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.503 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.1 OUTLIER -171.31 61.06 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.513 178.324 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.481 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -47.02 -31.99 3.65 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.838 0.351 . . . . 0.0 111.508 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.643 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -43.24 -68.38 0.81 Allowed Glycine 0 CA--C 1.519 0.315 0 CA-C-N 115.697 -0.683 . . . . 0.0 114.597 -178.178 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.73 ' NZ ' ' HA ' ' B' ' 12' ' ' GLU . 0.7 OUTLIER -77.58 -29.16 51.92 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -176.809 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.649 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 37.6 mt -53.75 -52.16 37.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 121.157 -0.217 . . . . 0.0 111.378 -178.656 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.556 HG22 ' O ' ' A' ' 41' ' ' GLY . 5.6 t -48.17 -45.73 33.89 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.98 0.419 . . . . 0.0 110.293 178.752 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.714 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -52.07 -60.48 7.56 Favored Glycine 0 N--CA 1.453 -0.232 0 CA-C-N 115.623 -0.717 . . . . 0.0 113.76 -179.512 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.628 ' SD ' ' HE3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.74 -52.85 62.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.703 0.252 . . . . 0.0 111.52 -178.215 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.528 HD12 ' HB2' ' B' ' 7' ' ' ASN . 1.7 mm? -80.32 7.94 8.52 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -178.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.494 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.08 -15.15 62.83 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.922 0.391 . . . . 0.0 110.573 179.423 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -79.59 20.49 0.57 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.842 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.467 HG22 ' HG2' ' A' ' 26' ' ' GLU . 0.2 OUTLIER -83.43 161.43 3.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.745 -179.942 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.449 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 3.5 m-20 -68.27 157.06 36.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.821 -178.419 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.916 ' HA ' HD23 ' A' ' 55' ' ' LEU . 20.7 m-80 -82.4 -31.42 29.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.149 178.037 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.477 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 1.0 OUTLIER -74.08 -30.86 62.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.348 0.594 . . . . 0.0 109.783 177.613 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.583 ' O ' ' HG2' ' A' ' 58' ' ' MET . 0.0 OUTLIER -78.77 -26.11 44.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.431 178.904 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.916 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -61.42 -49.51 76.58 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.674 -179.885 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.578 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 1.2 pp -62.81 -39.02 92.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.956 0.407 . . . . 0.0 110.69 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.646 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 13.2 t60 -62.37 -20.38 64.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.959 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.614 ' HB3' ' HG ' ' A' ' 65' ' ' LEU . 24.9 mmt -76.62 -51.58 11.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.115 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 56' ' ' LEU . 3.9 pp -64.48 -10.5 25.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.911 0.386 . . . . 0.0 110.429 179.22 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.646 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 0.0 OUTLIER -106.66 -8.22 17.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.747 179.501 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.603 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 3.3 m -122.82 79.93 49.39 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.203 -179.519 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -56.11 -32.75 87.94 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.161 1.907 . . . . 0.0 111.671 178.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -78.53 -51.54 9.81 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.891 -179.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.603 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 20.0 m -69.18 -52.07 31.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.951 0.405 . . . . 0.0 111.554 -177.778 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.869 ' HG ' HD22 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -57.81 -59.44 5.22 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.373 -178.535 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.672 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.7 OUTLIER -50.02 -33.18 17.26 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.116 -177.949 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.597 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 6.5 t -68.23 -39.1 82.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.2 0.524 . . . . 0.0 110.255 178.231 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.534 ' HE2' ' SD ' ' A' ' 58' ' ' MET . 1.6 ttpt -65.91 -59.12 4.16 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.434 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.497 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 42.1 t -62.57 -19.28 22.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.516 178.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.656 ' O ' HG22 ' A' ' 73' ' ' VAL . 18.5 t70 -54.88 -48.81 72.52 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 176.42 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.477 ' HB3' HD13 ' B' ' 6' ' ' LEU . 20.4 tt0 -68.88 -26.85 65.33 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.503 -0.772 . . . . 0.0 109.844 176.632 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.649 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -63.68 -47.09 82.61 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.185 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.656 HG22 ' O ' ' A' ' 70' ' ' ASP . 3.4 m -60.08 -28.87 42.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 177.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.455 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -70.39 -40.13 74.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.066 178.839 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.601 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -55.61 -35.45 38.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 CA-C-O 121.102 0.477 . . . . 0.0 109.811 178.862 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.436 HD13 ' C ' ' A' ' 76' ' ' LEU . 2.9 tm? -69.28 -47.28 65.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.754 177.673 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 20.1 mm-40 -52.07 -36.54 50.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.21 178.44 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.29 -27.46 35.06 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.63 178.395 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.423 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 79.1 t60 -64.19 -44.48 91.84 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.496 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -66.66 -19.65 65.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.819 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.1 -66.01 0.65 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.047 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 16.0 mttt -65.08 -18.45 65.32 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.088 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.423 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 1.9 tt0 -78.18 -49.31 14.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.063 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -79.51 -11.0 59.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.198 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -84.03 11.9 7.18 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.139 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -80.87 163.4 23.42 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.842 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 10.4 mttp -85.3 -176.16 6.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.009 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -83.4 7.57 16.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.09 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.4 t -77.4 140.07 17.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.021 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -85.7 86.63 7.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.814 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 66.9 m -80.06 -178.73 6.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.874 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.75 101.52 0.65 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.079 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 9.6 t -110.31 20.76 17.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.86 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -103.25 -138.04 9.72 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.574 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.2 p -84.74 132.05 47.58 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 120.621 0.248 . . . . 0.0 111.024 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -68.52 -175.67 0.95 Allowed 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.47 2.113 . . . . 0.0 112.191 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -82.88 87.86 6.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.962 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.006 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.978 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 21.6 m . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.789 0.328 . . . . 0.0 111.049 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.9 t -81.65 132.62 31.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.118 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 4.0 mmtm -86.92 109.45 19.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.904 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 4' ' ' SER . . . . . 0.485 ' HB3' ' O ' ' B' ' 7' ' ' ASN . 8.9 t -85.42 176.06 8.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.896 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -108.15 -48.75 3.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.98 -179.755 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.515 HD11 ' HG3' ' A' ' 68' ' ' LYS . 5.3 tp -68.66 -74.78 0.12 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.865 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 7' ' ' ASN . . . . . 0.528 ' HB2' HD12 ' A' ' 47' ' ' LEU . 1.3 t-20 -92.68 134.62 27.47 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.7 179.244 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -80.18 -4.17 13.04 Favored 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 122.297 1.998 . . . . 0.0 112.389 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 9' ' ' ASN . . . . . 0.506 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 18.0 m120 -123.28 50.9 1.51 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.852 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 10' ' ' ALA . . . . . 0.437 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.96 96.06 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.219 -0.446 . . . . 0.0 112.068 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.0 OUTLIER -119.07 164.71 15.11 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.685 0.279 . . . . 0.0 110.477 177.445 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 12' ' ' GLU . . . . . 0.73 ' HA ' ' NZ ' ' A' ' 42' ' ' LYS . 0.7 OUTLIER -62.67 161.86 11.6 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.284 -179.352 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 13' ' ' PHE . . . . . 0.714 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.1 t80 -88.69 102.28 14.83 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.71 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 25.7 t -109.68 94.62 17.21 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.943 178.516 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 15' ' ' PRO . . . . . 0.445 ' HB3' ' HA ' ' A' ' 22' ' ' GLN . 11.8 Cg_endo -55.34 -169.86 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 122.959 2.439 . . . . 0.0 112.99 -178.258 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 16' ' ' GLY . . . . . 0.504 ' C ' ' HD2' ' A' ' 21' ' ' LYS . . . 85.66 -42.38 3.15 Favored Glycine 0 N--CA 1.452 -0.234 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.367 -179.228 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 30.8 m -116.53 150.03 18.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.737 0.303 . . . . 0.0 111.293 178.837 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.574 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 0.7 OUTLIER -72.48 97.3 2.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.622 179.378 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.1 114.42 4.62 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.777 -179.655 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 83.96 81.67 1.01 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.38 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 25.9 p30 -96.48 172.74 7.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.765 0.317 . . . . 0.0 111.11 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 1.1 pt . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.056 179.959 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.415 ' HA2' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.489 2.195 0 N-CA-C 112.554 -0.218 . . . . 0.0 112.554 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.415 ' HD3' ' HA2' ' A' ' 1' ' ' GLY . 31.3 Cg_exo -59.46 -43.54 39.22 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.603 2.202 . . . . 0.0 112.225 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 77.3 mt -72.42 -178.73 2.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.005 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -86.9 39.71 3.09 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.753 -179.641 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.453 ' HA ' ' O ' ' A' ' 6' ' ' PRO . 92.1 p -76.18 158.07 82.34 Favored Pre-proline 0 C--N 1.329 -0.295 0 N-CA-C 110.767 -0.086 . . . . 0.0 110.767 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.453 ' O ' ' HA ' ' A' ' 5' ' ' SER . 8.2 Cg_exo -71.39 -159.89 1.54 Allowed 'Cis proline' 0 C--N 1.35 0.657 0 C-N-CA 124.119 -1.2 . . . . 0.0 112.615 -1.638 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.467 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.2 OUTLIER -81.26 -161.84 0.45 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.066 179.908 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.757 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 15.3 t -87.91 -32.63 18.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.626 -179.544 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.82 -33.49 70.46 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.228 0.537 . . . . 0.0 109.628 177.448 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 14.3 t -74.1 -35.93 64.22 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.874 177.431 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.757 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.6 mtm -64.37 -36.48 84.26 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.038 177.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.692 HD13 HH12 ' A' ' 27' ' ' ARG . 50.5 mt -53.02 -53.83 44.25 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.93 178.864 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.29 -25.14 66.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.667 177.357 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.9 t -101.56 24.65 9.43 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.706 -178.705 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.939 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -134.31 59.77 39.28 Favored Pre-proline 0 CA--C 1.533 0.302 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.915 179.462 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.486 ' HD3' ' N ' ' A' ' 15' ' ' ALA . 44.8 Cg_exo -58.0 -52.66 5.48 Favored 'Trans proline' 0 CA--C 1.538 0.709 0 C-N-CA 122.726 2.284 . . . . 0.0 113.938 -177.85 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.406 ' HD3' ' HB2' ' A' ' 16' ' ' PRO . 58.0 Cg_endo -70.31 -160.95 0.08 OUTLIER 'Trans proline' 0 C--N 1.355 0.912 0 C-N-CA 121.855 1.703 . . . . 0.0 112.308 -179.014 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.563 ' C ' HE21 ' A' ' 20' ' ' GLN . 48.3 mt-30 -73.86 67.51 1.23 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.283 178.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.939 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 1.6 tp10 -104.34 6.78 35.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.985 -178.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.563 HE21 ' C ' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -47.33 -55.08 9.48 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.482 -178.725 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.645 ' HD3' ' H ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.79 -26.4 45.89 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.779 -178.444 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.84 ' HA ' ' HB3' ' B' ' 15' ' ' PRO . 0.6 OUTLIER -72.47 -76.75 0.11 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.765 0.317 . . . . 0.0 111.643 -179.44 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.556 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.16 -96.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -176.841 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.556 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -62.07 -1.95 0.81 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 113.596 0.962 . . . . 0.0 113.596 -175.219 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.43 ' HA3' HD11 ' A' ' 48' ' ' LEU . . . 65.05 -115.75 8.12 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 108.497 -1.841 . . . . 0.0 108.497 -174.062 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.454 ' O ' HD13 ' A' ' 24' ' ' LEU . 0.5 OUTLIER -75.98 -69.9 0.47 Allowed 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 168.995 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.757 ' HG3' HD21 ' A' ' 31' ' ' LEU . 9.5 tpt180 -159.7 13.22 0.14 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 114.282 -1.326 . . . . 0.0 108.029 175.256 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.634 HD12 HD11 ' A' ' 32' ' ' ILE . 3.9 mm? -57.32 -76.46 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.513 -1.221 . . . . 0.0 113.506 -174.218 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.639 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -37.25 -49.87 2.36 Favored Pre-proline 0 CA--C 1.535 0.381 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -175.122 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.556 ' HG2' ' HD2' ' A' ' 27' ' ' ARG . 50.0 Cg_exo -56.71 -43.64 52.86 Favored 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 122.249 1.966 . . . . 0.0 113.64 -177.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.781 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.66 -47.39 60.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.141 0.496 . . . . 0.0 110.185 -178.432 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.753 HG21 HD12 ' A' ' 43' ' ' ILE . 0.5 OUTLIER -75.36 -13.16 15.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.499 178.845 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.658 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 55.0 tp60 -62.59 -39.55 94.07 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 177.025 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.55 -31.93 72.95 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.266 -0.879 . . . . 0.0 108.814 174.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.492 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 6.2 mtt -100.73 27.2 6.08 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.409 177.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.658 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.9 p-80 -64.06 -33.19 8.92 Favored Pre-proline 0 CA--C 1.535 0.399 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 -177.097 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.546 ' HD3' ' ND1' ' A' ' 36' ' ' HIS . 53.2 Cg_exo -37.11 -30.39 0.11 Allowed 'Trans proline' 0 C--N 1.361 1.187 0 C-N-CA 122.286 1.991 . . . . 0.0 112.36 179.557 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.912 HG21 HG13 ' A' ' 73' ' ' VAL . 90.2 m -78.28 -85.17 0.07 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.238 177.33 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.533 ' O ' HG13 ' A' ' 43' ' ' ILE . 7.9 tp -171.11 51.29 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.21 178.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.456 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -39.83 -38.18 0.64 Allowed 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.852 -179.547 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.639 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.08 -55.72 9.87 Favored Glycine 0 C--N 1.331 0.289 0 CA-C-N 116.096 -0.502 . . . . 0.0 114.012 -179.174 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.899 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -78.27 -34.27 49.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 117.098 0.449 . . . . 0.0 111.817 -178.654 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.753 HD12 HG21 ' A' ' 32' ' ' ILE . 0.9 OUTLIER -54.11 -55.84 12.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.613 0.245 . . . . 0.0 111.238 -179.083 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.559 HG21 ' CD2' ' A' ' 29' ' ' PHE . 5.2 t -47.22 -49.17 23.67 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.477 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.575 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -50.23 -51.44 30.98 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 121.092 -0.575 . . . . 0.0 112.901 179.149 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.516 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 3.1 mmm -55.72 -68.05 0.23 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.332 0.587 . . . . 0.0 111.364 -179.404 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.74 HD11 ' HB2' ' B' ' 6' ' ' LEU . 4.0 mm? -74.15 10.62 1.16 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.184 -0.917 . . . . 0.0 111.701 -177.425 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.522 ' HB3' ' HD2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -66.17 -24.39 66.64 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.972 0.415 . . . . 0.0 110.302 178.835 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.479 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 3.0 mt-10 -74.59 22.38 0.1 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.967 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.628 HD11 ' HE3' ' A' ' 68' ' ' LYS . 2.6 tt -83.63 166.87 2.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.76 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.447 ' HB2' ' HG3' ' A' ' 54' ' ' GLU . 7.6 m-20 -70.82 155.29 40.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.419 -179.422 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.882 ' HA ' HD23 ' A' ' 55' ' ' LEU . 15.3 m-80 -83.21 -29.62 28.38 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.064 178.062 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.06 -31.88 63.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.747 177.547 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.447 ' HG3' ' HB2' ' A' ' 51' ' ' ASP . 6.1 mt-10 -79.46 -27.17 41.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.699 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.882 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -59.47 -46.73 87.97 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.084 0.469 . . . . 0.0 109.925 179.123 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.496 ' O ' ' HG3' ' A' ' 60' ' ' GLU . 1.0 OUTLIER -61.2 -44.93 96.49 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.653 179.403 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 25.7 t60 -57.08 -40.33 76.7 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.055 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.527 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -58.91 -42.39 89.51 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.645 179.184 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.653 HD12 ' NE ' ' A' ' 27' ' ' ARG . 9.0 tt -63.8 -24.53 67.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.063 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.496 ' HG3' ' O ' ' A' ' 56' ' ' LEU . 17.4 mt-10 -105.3 2.89 29.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.338 -178.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.565 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 43.6 m -122.66 78.24 47.66 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.675 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.458 ' O ' ' HB2' ' A' ' 66' ' ' ARG . 18.7 Cg_endo -57.84 -34.94 98.94 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.339 2.026 . . . . 0.0 112.099 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -78.39 -46.96 18.63 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.728 -179.617 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.524 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 12.8 m -72.91 -53.39 11.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.648 -177.734 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.781 HD21 HD13 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -57.82 -58.9 6.34 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.264 -178.387 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.686 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -50.94 -36.24 37.61 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.859 -0.337 . . . . 0.0 111.102 -178.246 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.4 m -69.39 -36.25 76.58 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.071 0.462 . . . . 0.0 110.292 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.628 ' HE3' HD11 ' A' ' 50' ' ' ILE . 5.5 ttpt -65.77 -56.26 12.89 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.263 178.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.52 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 30.2 t -64.85 -21.23 28.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.36 178.537 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.428 ' HB2' ' O ' ' A' ' 66' ' ' ARG . 13.7 t70 -53.45 -48.03 69.18 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 177.295 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.419 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 0.4 OUTLIER -68.83 -32.92 72.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.767 176.836 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.646 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -55.69 -42.44 75.2 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.163 177.695 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.912 HG13 HG21 ' A' ' 38' ' ' THR . 24.4 t -60.82 -31.65 50.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 176.647 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.419 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -73.46 -36.41 65.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.604 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.569 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -57.73 -28.22 31.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.895 0.379 . . . . 0.0 110.092 179.79 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.899 HD11 ' HB3' ' A' ' 42' ' ' LYS . 3.0 mm? -71.62 -54.31 10.83 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.534 178.358 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -51.12 -34.63 31.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.439 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.491 ' O ' ' HB2' ' A' ' 82' ' ' LYS . . . -81.5 -30.91 33.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.828 178.479 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 12.5 t-160 -64.58 -30.68 71.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.083 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -83.93 -40.51 18.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.759 -179.346 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -78.78 -54.8 5.71 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -177.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 78' ' ' ALA . 8.0 mmtt -59.46 -31.3 69.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.697 -178.07 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -81.27 -46.16 15.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.979 -179.543 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.537 ' HA ' ' HG3' ' A' ' 87' ' ' LYS . . . -80.16 8.29 7.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.117 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -73.06 -50.01 25.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.062 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -76.43 -15.16 59.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.957 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.537 ' HG3' ' HA ' ' A' ' 84' ' ' ALA . 0.1 OUTLIER -83.31 -167.76 1.82 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.988 179.931 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.91 83.64 0.94 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.161 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.66 HG22 ' H ' ' A' ' 91' ' ' SER . 13.8 p -83.35 144.77 9.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.012 179.735 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -84.06 11.4 8.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.132 -179.626 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.66 ' H ' HG22 ' A' ' 89' ' ' VAL . 7.9 t -83.93 135.96 34.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.015 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.91 109.61 12.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.966 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.81 144.95 32.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.003 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.487 ' O ' ' HD3' ' A' ' 96' ' ' PRO . . . -91.44 -59.67 1.35 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.484 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 1.1 m -108.02 94.15 12.27 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.649 0.262 . . . . 0.0 111.141 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.487 ' HD3' ' O ' ' A' ' 94' ' ' GLY . 37.2 Cg_exo -57.81 120.51 8.47 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.558 2.172 . . . . 0.0 112.256 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 81.5 p -84.65 1.9 44.11 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.865 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.931 -179.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 7.2 p . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.722 0.296 . . . . 0.0 111.092 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 5.6 m -80.86 135.93 24.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.899 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 3' ' ' LYS . . . . . 0.411 ' N ' ' HE3' ' B' ' 3' ' ' LYS . 0.0 OUTLIER -94.24 81.99 4.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.966 -179.797 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.67 161.62 16.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.653 179.754 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -104.32 -66.7 0.94 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.078 -179.307 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.74 ' HB2' HD11 ' A' ' 47' ' ' LEU . 16.6 mt -64.85 -87.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.774 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 7' ' ' ASN . . . . . 0.631 ' HB2' HD13 ' A' ' 47' ' ' LEU . 1.4 t-20 -74.46 124.97 90.19 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.708 179.212 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -79.07 3.82 7.08 Favored 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.18 1.92 . . . . 0.0 112.111 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 9' ' ' ASN . . . . . 0.507 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 16.8 m120 -123.53 44.5 2.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.902 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 10' ' ' ALA . . . . . 0.516 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.57 98.13 0.06 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.494 179.552 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.507 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.1 OUTLIER -122.24 -179.51 4.2 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.634 178.848 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -68.46 172.29 6.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.82 179.055 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 13' ' ' PHE . . . . . 0.575 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.1 t80 -101.03 107.33 18.75 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.974 0.416 . . . . 0.0 110.93 179.509 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 1.1 m -111.6 92.07 15.99 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.384 178.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 15' ' ' PRO . . . . . 0.84 ' HB3' ' HA ' ' A' ' 22' ' ' GLN . 53.1 Cg_exo -55.42 -172.83 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.735 2.29 . . . . 0.0 112.775 -178.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 16' ' ' GLY . . . . . 0.441 ' O ' ' HE3' ' A' ' 21' ' ' LYS . . . 85.0 -43.16 3.22 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.412 -179.514 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -115.77 142.31 29.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.745 0.307 . . . . 0.0 110.931 179.472 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.613 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 9.1 mttt -67.19 98.99 0.64 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.788 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.522 ' HD2' ' HB3' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -73.36 118.68 16.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.902 179.906 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 87.62 28.35 24.51 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.518 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 24.0 t30 -89.24 69.85 8.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.792 0.329 . . . . 0.0 110.849 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 2.8 tp . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.286 -0.864 . . . . 0.0 111.127 -179.877 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.112 0 CA-C-O 120.143 -0.254 . . . . 0.0 112.561 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -77.03 -175.61 2.75 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.588 2.192 . . . . 0.0 112.253 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -91.77 81.2 5.23 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.877 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -101.43 94.42 1.24 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.484 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.0 t -95.06 132.85 27.26 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 120.648 0.261 . . . . 0.0 110.838 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.05 -154.95 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.549 2.166 . . . . 0.0 112.224 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.513 HD12 ' HB2' ' A' ' 10' ' ' SER . 0.0 OUTLIER -92.67 -173.62 3.4 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.662 179.647 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.792 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 3.6 t -87.93 -31.31 19.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.273 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.37 -35.43 73.9 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 176.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.513 ' HB2' HD12 ' A' ' 7' ' ' LEU . 1.7 t -71.08 -36.19 72.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.623 177.116 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.792 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.3 mtm -64.23 -34.4 78.01 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.896 177.807 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.686 HD12 ' SD ' ' A' ' 23' ' ' MET . 1.2 mp -52.74 -52.61 55.68 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.843 178.351 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.02 -26.99 67.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.915 178.312 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.406 ' C ' ' HD3' ' A' ' 16' ' ' PRO . 4.7 p -101.5 21.23 14.61 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.74 -178.795 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.902 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -134.09 55.92 17.14 Favored Pre-proline 0 CA--C 1.534 0.358 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.208 179.752 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.551 ' HD3' ' N ' ' A' ' 15' ' ' ALA . 52.2 Cg_exo -57.81 -49.67 12.47 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 122.658 2.239 . . . . 0.0 114.095 -178.341 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.448 ' HD2' ' N ' ' A' ' 16' ' ' PRO . 53.1 Cg_endo -69.11 -157.34 0.04 OUTLIER 'Trans proline' 0 C--N 1.355 0.913 0 C-N-CA 121.928 1.752 . . . . 0.0 112.765 -178.377 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -74.64 47.44 0.32 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.401 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.902 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 1.7 tp10 -86.05 15.7 4.84 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.373 179.53 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.53 -68.29 0.18 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.628 -179.082 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.561 ' HE2' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.4 -18.49 6.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.371 -178.066 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.648 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 5.4 tp60 -73.6 -79.82 0.08 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.901 0.381 . . . . 0.0 111.336 178.878 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.686 ' SD ' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.57 -96.09 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 N-CA-C 112.616 0.599 . . . . 0.0 112.616 -177.08 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.628 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -61.04 0.43 0.23 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.059 0.762 . . . . 0.0 113.059 -176.064 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.584 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.4 -118.12 12.1 Favored Glycine 0 N--CA 1.446 -0.655 0 N-CA-C 108.332 -1.907 . . . . 0.0 108.332 -175.011 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.444 ' O ' HD13 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -75.98 -67.65 0.66 Allowed 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 168.71 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.631 ' HB2' HD13 ' A' ' 55' ' ' LEU . 5.2 tpt180 -160.16 12.0 0.12 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.385 -1.28 . . . . 0.0 108.442 175.373 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.621 HD12 HD11 ' A' ' 32' ' ' ILE . 4.2 mm? -57.82 -80.44 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.846 -1.07 . . . . 0.0 113.713 -174.16 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.675 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -33.46 -50.16 0.74 Allowed Pre-proline 0 CA--C 1.537 0.446 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -175.223 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.603 ' HG2' ' O ' ' A' ' 27' ' ' ARG . 12.7 Cg_endo -59.16 -42.15 53.4 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.204 1.936 . . . . 0.0 113.521 -177.785 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.624 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.09 -45.76 63.08 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 120.144 -0.622 . . . . 0.0 110.151 -179.147 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.621 HD11 HD12 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -74.7 -12.36 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.998 178.142 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.642 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 60.3 tp60 -62.13 -39.29 92.08 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 176.521 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.0 -31.66 71.52 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.298 -0.864 . . . . 0.0 109.076 174.672 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.521 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 7.1 mtt -100.54 28.13 5.31 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.225 178.014 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.642 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.2 OUTLIER -64.09 -31.95 6.88 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 -177.267 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.543 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 63.0 Cg_exo -37.68 -30.51 0.14 Allowed 'Trans proline' 0 C--N 1.361 1.236 0 C-N-CA 122.047 1.831 . . . . 0.0 112.159 179.055 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.906 HG21 HG13 ' A' ' 73' ' ' VAL . 0.2 OUTLIER -78.16 -89.11 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.737 176.578 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.53 ' H ' ' HB ' ' A' ' 38' ' ' THR . 0.1 OUTLIER -171.24 58.4 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.92 177.718 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.49 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -43.47 -35.4 1.61 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.743 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.661 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.16 -57.42 8.02 Favored Glycine 0 C--O 1.229 -0.216 0 CA-C-N 115.961 -0.563 . . . . 0.0 114.098 -178.474 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.537 ' HE3' ' HA ' ' B' ' 12' ' ' GLU . 1.6 tptm -79.03 -39.01 35.11 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 117.085 0.442 . . . . 0.0 112.15 -178.423 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.697 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 17.2 mt -53.09 -48.62 53.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 C-N-CA 121.155 -0.218 . . . . 0.0 111.426 -177.685 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.527 HG21 ' CD2' ' A' ' 29' ' ' PHE . 5.1 t -47.86 -48.04 31.33 Favored 'General case' 0 CA--C 1.521 -0.17 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 178.596 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.565 ' CA ' ' HB2' ' B' ' 13' ' ' PHE . . . -56.67 -53.25 45.17 Favored Glycine 0 N--CA 1.449 -0.458 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.871 179.212 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.921 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.33 -56.43 20.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.794 0.33 . . . . 0.0 110.982 -179.112 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.623 HD22 ' HB2' ' A' ' 46' ' ' MET . 2.9 mm? -80.28 7.76 8.83 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.397 -179.247 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.484 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.46 -20.9 66.55 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.791 0.329 . . . . 0.0 110.748 179.897 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.48 ' HG3' ' O ' ' B' ' 9' ' ' ASN . 3.6 mt-10 -75.71 20.27 0.18 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.888 179.354 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.64 HD11 ' HE3' ' A' ' 68' ' ' LYS . 2.7 tt -83.58 169.07 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.905 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.44 ' HB2' ' HG3' ' A' ' 54' ' ' GLU . 2.6 m-20 -71.03 155.93 40.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.951 0.405 . . . . 0.0 111.427 -179.626 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.809 ' HA ' HD23 ' A' ' 55' ' ' LEU . 12.0 m-80 -88.06 -28.46 21.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.643 177.238 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.96 -30.67 62.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.608 177.125 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.578 ' O ' ' HG2' ' A' ' 58' ' ' MET . 4.0 mt-10 -77.26 -29.41 53.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.49 178.776 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.809 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -58.79 -46.1 88.36 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.209 -179.901 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.428 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 7.6 tp -60.75 -47.38 86.56 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.558 178.744 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -65.72 -20.07 66.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.375 -179.644 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.631 ' SD ' ' HA ' ' A' ' 65' ' ' LEU . 25.3 mmt -69.65 -54.57 13.28 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.054 -179.708 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.54 HD23 ' CG ' ' A' ' 27' ' ' ARG . 0.1 OUTLIER -63.27 -17.87 62.96 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.893 0.377 . . . . 0.0 110.685 179.479 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.478 ' O ' ' HG3' ' A' ' 60' ' ' GLU . 0.0 OUTLIER -94.73 -13.26 25.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.788 -179.856 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.595 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.5 OUTLIER -122.3 87.66 48.44 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.189 -179.872 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -59.31 -32.22 96.41 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.268 1.979 . . . . 0.0 112.129 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -77.78 -49.77 13.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.618 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.421 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 75.5 m -69.16 -46.34 67.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.185 -178.469 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.631 ' HA ' ' SD ' ' A' ' 58' ' ' MET . 1.2 tp -60.17 -64.74 0.84 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.814 -178.583 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.57 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -49.54 -28.83 5.98 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.875 -177.933 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.482 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 9.2 t -62.32 -45.32 93.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.181 177.843 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.64 ' HE3' HD11 ' A' ' 50' ' ' ILE . 14.2 mtmm -66.45 -62.05 1.67 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.921 179.355 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.471 ' HA ' ' HB3' ' A' ' 72' ' ' ALA . 73.2 t -57.75 -20.72 14.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.756 -179.321 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.482 ' HB3' ' O ' ' A' ' 67' ' ' SER . 10.0 t70 -57.26 -49.22 76.74 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 175.688 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.468 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 5.7 tt0 -67.18 -27.76 67.54 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.547 175.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.697 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -66.1 -36.68 83.83 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.586 178.722 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.906 HG13 HG21 ' A' ' 38' ' ' THR . 5.1 t -59.94 -32.85 50.94 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.184 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 176.23 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -73.69 -34.18 64.76 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.824 175.379 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.594 ' HB ' ' O ' ' A' ' 72' ' ' ALA . 15.7 t -55.03 -33.07 28.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.919 178.205 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.634 ' HB2' HG12 ' A' ' 43' ' ' ILE . 3.1 tm? -71.36 -47.08 58.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.173 177.581 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 32.6 mm-40 -63.87 -24.05 67.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.048 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.8 -24.94 38.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.834 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.576 ' O ' ' HB3' ' A' ' 83' ' ' GLU . 26.1 t-80 -68.48 -41.68 79.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.861 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -62.86 -14.9 51.71 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.267 -179.678 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -76.55 -54.55 6.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.138 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.03 -19.51 47.49 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.115 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.576 ' HB3' ' O ' ' A' ' 79' ' ' HIS . 0.2 OUTLIER -75.36 -47.17 28.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.674 179.986 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.412 ' N ' ' HG3' ' A' ' 83' ' ' GLU . . . -65.6 -13.63 59.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.057 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -74.63 -14.61 60.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.98 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -77.34 -55.69 5.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.808 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.15 -72.23 0.43 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.858 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -74.56 93.16 2.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.086 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 4.6 t -92.75 102.47 13.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.047 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.15 76.07 1.7 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.838 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.01 179.86 7.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.966 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.02 90.65 4.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.982 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 19.1 p -97.55 -178.81 4.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.906 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -83.82 81.28 1.76 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.467 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 1.9 t -104.8 113.34 64.99 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 120.632 0.254 . . . . 0.0 111.125 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -60.04 167.87 6.75 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.715 2.277 . . . . 0.0 112.206 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 14.1 p -91.14 145.92 24.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.858 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 1.4 t . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.036 -0.983 . . . . 0.0 111.084 -179.796 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 8.3 p . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 121.217 0.532 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 5.9 p -84.17 134.21 27.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.13 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.31 172.2 8.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.053 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 4' ' ' SER . . . . . 0.409 ' HB2' ' HB3' ' B' ' 10' ' ' ALA . 4.5 t -83.26 -150.02 0.1 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.601 179.483 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 56.6 m-20 -103.89 -62.13 1.35 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.65 0.262 . . . . 0.0 110.943 -179.509 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.582 ' HB3' HD11 ' A' ' 47' ' ' LEU . 27.1 tp -71.92 -83.68 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.381 179.318 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 7' ' ' ASN . . . . . 0.422 ' HA ' ' HD3' ' B' ' 8' ' ' PRO . 1.7 t-20 -82.81 129.15 63.08 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.267 178.151 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 7.1 Cg_exo -73.94 4.25 4.35 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.187 1.924 . . . . 0.0 111.997 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 9' ' ' ASN . . . . . 0.48 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 18.5 m120 -123.63 37.42 4.42 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.308 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 10' ' ' ALA . . . . . 0.921 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.43 87.5 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.087 179.263 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.45 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 1.5 mmtp -116.21 177.86 4.53 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.964 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 12' ' ' GLU . . . . . 0.537 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -68.21 158.76 32.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.72 0.295 . . . . 0.0 111.065 179.76 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 13' ' ' PHE . . . . . 0.565 ' HB2' ' CA ' ' A' ' 45' ' ' GLY . 1.1 t80 -88.86 110.27 20.92 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.857 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 1.2 m -111.58 87.64 8.29 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.342 178.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 15' ' ' PRO . . . . . 0.488 ' HD3' ' O ' ' B' ' 13' ' ' PHE . 52.0 Cg_exo -55.72 -166.17 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 122.889 2.393 . . . . 0.0 113.139 -178.49 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.3 -50.86 4.43 Favored Glycine 0 N--CA 1.452 -0.239 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.386 -179.316 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 10.9 m -116.69 161.8 15.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.728 0.299 . . . . 0.0 111.027 178.663 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.412 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -75.95 96.6 3.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.672 179.356 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -65.0 99.28 0.34 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.943 -179.664 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 78.66 71.6 1.23 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.424 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 14.2 p-10 -101.42 131.4 47.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.744 0.307 . . . . 0.0 110.888 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 23.1 mm . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.189 -0.91 . . . . 0.0 111.065 -179.847 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.19 0 N-CA-C 112.45 -0.26 . . . . 0.0 112.45 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -57.23 165.99 4.86 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.622 2.215 . . . . 0.0 112.277 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.23 89.29 7.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.79 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -98.03 -27.92 8.54 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.595 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 16.8 t -88.89 110.97 41.68 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 120.549 0.214 . . . . 0.0 110.902 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -68.09 153.61 74.5 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.478 2.119 . . . . 0.0 112.312 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.428 ' O ' ' HG3' ' A' ' 11' ' ' MET . 6.7 mp -86.55 -174.99 5.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.87 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.815 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 12.7 t -87.93 -26.17 22.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.236 179.679 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.61 -41.01 89.41 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 176.266 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 7.5 t -67.44 -33.79 75.88 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.508 176.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.815 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.1 mtm -64.25 -37.24 86.79 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.182 177.844 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.842 HD21 ' HB3' ' A' ' 24' ' ' LEU . 22.9 mt -54.28 -45.99 72.62 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.547 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.8 -36.3 82.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.102 178.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -101.16 46.55 0.94 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.047 -179.655 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.794 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -133.06 -41.33 0.03 OUTLIER Pre-proline 0 CA--C 1.536 0.437 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 -178.076 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.744 ' HD2' ' H ' ' A' ' 15' ' ' ALA . 70.4 Cg_exo -46.52 154.63 0.9 Allowed 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 121.866 1.71 . . . . 0.0 112.893 -176.673 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.725 ' O ' ' HA ' ' A' ' 16' ' ' PRO . 14.4 Cg_exo -71.75 -99.45 0.0 OUTLIER 'Cis proline' 0 CA--C 1.539 0.737 0 C-N-CA 124.251 -1.146 . . . . 0.0 114.414 3.225 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.507 ' H ' ' HB2' ' A' ' 17' ' ' PRO . 17.9 mt-30 -74.82 65.68 1.41 Allowed 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 113.307 0.854 . . . . 0.0 113.307 -175.438 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.794 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 1.1 tp10 -105.63 12.94 30.57 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.64 0.257 . . . . 0.0 110.876 176.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.797 HE22 ' HE2' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -47.0 -56.7 5.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.605 -178.853 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.621 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -56.07 -22.34 27.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.648 -178.359 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.621 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 5.4 tp60 -73.46 -79.91 0.08 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.915 0.388 . . . . 0.0 111.677 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.742 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.76 -96.22 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -176.47 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.842 ' HB3' HD21 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -59.26 -2.45 0.29 Allowed 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 113.647 0.98 . . . . 0.0 113.647 -175.359 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.636 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.48 -116.78 9.45 Favored Glycine 0 N--CA 1.448 -0.549 0 N-CA-C 108.374 -1.891 . . . . 0.0 108.374 -174.621 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.446 ' HG2' ' O ' ' A' ' 51' ' ' ASP . 0.8 OUTLIER -76.23 -69.14 0.52 Allowed 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 168.269 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.766 ' NE ' HD13 ' A' ' 59' ' ' LEU . 0.2 OUTLIER -159.82 13.1 0.13 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.163 -1.381 . . . . 0.0 108.178 174.56 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.546 ' O ' HG13 ' A' ' 32' ' ' ILE . 4.1 mm? -57.64 -78.57 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.662 -1.153 . . . . 0.0 113.439 -174.379 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.617 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -37.42 -48.88 2.47 Favored Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 -174.799 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.59 ' HG3' ' HB2' ' A' ' 24' ' ' LEU . 12.6 Cg_endo -58.69 -43.29 45.82 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 122.14 1.893 . . . . 0.0 113.621 -177.576 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.19 -46.69 60.74 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 120.111 -0.636 . . . . 0.0 110.289 -178.719 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.546 HG13 ' O ' ' A' ' 28' ' ' LEU . 0.4 OUTLIER -73.28 -12.47 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 CA-C-N 116.208 -0.451 . . . . 0.0 109.969 178.224 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.608 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 47.7 tp60 -62.14 -40.54 96.3 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 176.788 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.62 -29.98 69.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.08 174.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.536 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 6.7 mtt -101.65 27.17 6.61 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.394 178.428 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.608 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -63.66 -32.08 7.49 Favored Pre-proline 0 CA--C 1.537 0.445 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -177.594 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.572 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 50.5 Cg_exo -35.97 -32.55 0.1 Allowed 'Trans proline' 0 C--N 1.363 1.342 0 C-N-CA 122.178 1.919 . . . . 0.0 112.034 178.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.837 HG21 HG13 ' A' ' 73' ' ' VAL . 7.2 m -78.14 -88.58 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.512 176.014 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.509 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.3 OUTLIER -171.59 62.73 0.03 OUTLIER 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.196 177.552 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.516 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -46.67 -34.72 5.32 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.662 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.617 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -52.88 -53.94 30.93 Favored Glycine 0 C--N 1.33 0.239 0 C-N-CA 121.17 -0.538 . . . . 0.0 113.81 -178.439 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.501 ' HD2' ' HG2' ' B' ' 12' ' ' GLU . 0.0 OUTLIER -78.11 -39.0 42.7 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.887 0.343 . . . . 0.0 111.797 -178.387 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.692 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 31.8 mt -53.95 -54.14 22.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.038 -179.385 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.583 HG21 ' CD2' ' A' ' 29' ' ' PHE . 6.4 t -50.17 -45.69 53.58 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 120.889 0.376 . . . . 0.0 110.121 178.003 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.565 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -50.83 -67.46 1.92 Allowed Glycine 0 N--CA 1.451 -0.317 0 CA-C-N 115.606 -0.724 . . . . 0.0 113.235 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.462 ' H ' ' HG2' ' A' ' 46' ' ' MET . 0.0 OUTLIER -56.05 -46.06 79.05 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 -178.031 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.44 HD22 ' N ' ' A' ' 47' ' ' LEU . 3.3 mm? -80.11 3.09 21.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.719 -0.219 . . . . 0.0 111.588 -178.819 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.565 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.96 -8.24 21.51 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.938 0.399 . . . . 0.0 110.54 179.253 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.449 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 1.4 mm-40 -83.47 18.36 1.87 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.373 178.433 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.405 HG23 ' O ' ' A' ' 51' ' ' ASP . 1.5 tt -83.27 163.85 2.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.96 -179.272 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.446 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 3.4 m-20 -70.81 157.56 37.88 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.564 -179.124 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.83 ' HA ' HD23 ' A' ' 55' ' ' LEU . 4.6 m120 -86.61 -28.83 23.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.969 177.81 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 8.7 m -73.9 -32.09 63.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.644 177.55 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -75.98 -29.5 58.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.554 178.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.83 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.5 OUTLIER -59.45 -47.74 84.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.504 -179.766 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.462 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 52.4 tp -61.7 -40.72 96.02 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.712 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -66.02 -30.95 71.58 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.164 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.48 -54.85 22.38 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.897 -179.601 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.766 HD13 ' NE ' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -66.1 -13.08 59.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.115 0.483 . . . . 0.0 110.123 178.76 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.506 ' O ' ' HG3' ' A' ' 60' ' ' GLU . 2.3 tp10 -95.46 -12.92 25.07 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.631 177.537 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.547 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 4.1 m -122.57 79.58 47.21 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.732 179.788 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -54.58 -34.21 81.87 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.398 2.065 . . . . 0.0 112.206 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -77.95 -49.72 13.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.552 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.445 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 3.7 m -71.23 -23.12 61.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.904 0.383 . . . . 0.0 111.4 -178.607 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.549 ' HG ' ' N ' ' A' ' 66' ' ' ARG . 1.7 tp -78.54 -64.87 1.07 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.639 -178.474 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.549 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 1.5 ttm180 -51.43 -29.27 15.41 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.849 -178.104 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.56 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 3.3 t -69.67 -40.84 76.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.301 0.572 . . . . 0.0 110.005 177.712 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.628 ' O ' HD11 ' B' ' 6' ' ' LEU . 21.4 ttpt -65.74 -59.69 3.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.203 178.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.506 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 54.1 t -62.47 -19.89 23.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.637 179.222 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.56 ' HB3' ' O ' ' A' ' 67' ' ' SER . 17.1 t70 -54.07 -48.99 70.05 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 176.531 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -66.77 -32.9 74.5 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.658 176.381 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.692 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -58.19 -38.11 76.09 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.525 178.877 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.837 HG13 HG21 ' A' ' 38' ' ' THR . 8.0 t -65.26 -31.4 53.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.61 177.421 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.1 -37.08 69.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.146 179.25 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.66 HG12 ' HB2' ' B' ' 5' ' ' ASN . 0.9 OUTLIER -57.61 -31.71 40.2 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.115 0 CA-C-O 121.168 0.508 . . . . 0.0 109.955 178.989 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.64 HD12 HG22 ' A' ' 38' ' ' THR . 2.8 tm? -71.24 -49.91 38.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.39 179.061 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -54.94 -37.33 66.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.664 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.15 -24.28 37.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.811 179.133 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.486 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 6.6 t60 -66.1 -53.84 33.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.816 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -66.13 -15.37 63.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.042 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -63.5 -66.59 0.52 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.912 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.68 -11.9 60.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.775 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.486 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 0.2 OUTLIER -83.66 -25.63 30.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.846 179.757 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.22 -24.94 67.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.04 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.41 -46.99 80.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.987 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 4.9 mm100 -81.41 -161.68 0.44 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.811 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.94 101.4 5.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.823 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -84.03 65.49 8.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.926 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -97.44 173.43 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.03 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -91.66 -57.35 2.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.958 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.46 109.1 12.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.955 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -87.93 -63.56 1.28 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.055 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 22.4 p -111.18 -177.64 3.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.888 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -101.71 89.66 0.78 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.524 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.0 m -95.81 141.44 23.18 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 120.633 0.254 . . . . 0.0 111.051 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -58.29 -71.24 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.618 2.212 . . . . 0.0 112.409 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.4 m -107.11 -65.03 1.13 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.97 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 16.7 m . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.071 -0.966 . . . . 0.0 111.03 -179.959 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 1.5 t . . . . . 0 N--CA 1.487 1.417 0 CA-C-O 120.886 0.374 . . . . 0.0 110.859 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 19.2 t -81.39 138.69 19.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.999 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 4.9 mtpm? -91.84 85.32 5.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.061 -179.516 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.36 179.79 5.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.769 179.838 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 5' ' ' ASN . . . . . 0.66 ' HB2' HG12 ' A' ' 75' ' ' VAL . 0.4 OUTLIER -104.01 -77.12 0.58 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.881 -179.549 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.628 HD11 ' O ' ' A' ' 68' ' ' LYS . 5.6 mt -62.81 -85.32 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.808 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 7' ' ' ASN . . . . . 0.448 ' HA ' ' HD3' ' B' ' 8' ' ' PRO . 1.1 t-20 -75.85 130.05 79.63 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.866 179.538 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 6.6 Cg_exo -73.28 -3.41 13.63 Favored 'Trans proline' 0 N--CA 1.46 -0.475 0 C-N-CA 122.368 2.045 . . . . 0.0 111.625 178.654 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 9' ' ' ASN . . . . . 0.409 ' HB3' ' NZ ' ' B' ' 11' ' ' LYS . 2.5 m-80 -123.48 51.97 1.45 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.636 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.86 95.67 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.756 -179.156 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.449 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 9.6 mttp -121.57 121.69 37.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.027 178.072 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 12' ' ' GLU . . . . . 0.501 ' HG2' ' HD2' ' A' ' 42' ' ' LYS . 6.0 mt-10 -49.68 176.87 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.315 0.579 . . . . 0.0 112.366 -177.823 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 13' ' ' PHE . . . . . 0.552 ' CE1' ' HG ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -87.24 97.08 10.57 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.248 179.952 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 14' ' ' VAL . . . . . 0.616 ' HB ' ' HD3' ' B' ' 15' ' ' PRO . 2.8 t -129.29 -53.98 0.03 OUTLIER Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.489 -178.082 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 15' ' ' PRO . . . . . 0.616 ' HD3' ' HB ' ' B' ' 14' ' ' VAL . 85.9 Cg_exo -47.73 -36.39 25.66 Favored 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 122.311 2.007 . . . . 0.0 112.806 -178.702 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 16' ' ' GLY . . . . . 0.549 ' O ' ' HB2' ' A' ' 21' ' ' LYS . . . 75.98 -8.84 20.79 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.475 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 4.6 m -104.81 -172.33 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 N-CA-C 110.518 -0.179 . . . . 0.0 110.518 179.429 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.797 ' HE2' HE22 ' A' ' 20' ' ' GLN . 9.0 mttt -59.8 90.68 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.925 0.393 . . . . 0.0 110.625 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.444 ' HB3' ' O ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -81.11 132.12 35.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.0 -179.222 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 92.99 -55.53 2.55 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.489 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -101.91 169.91 8.48 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.873 0.368 . . . . 0.0 110.955 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.19 -0.91 . . . . 0.0 111.052 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.31 0 N-CA-C 112.515 -0.234 . . . . 0.0 112.515 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.68 123.28 9.97 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.516 2.144 . . . . 0.0 112.217 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 mp -91.71 155.06 18.56 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.972 -179.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -89.26 26.07 9.5 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.467 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.551 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 23.6 t -77.51 -50.92 1.98 Allowed Pre-proline 0 C--N 1.329 -0.29 0 N-CA-C 111.36 0.133 . . . . 0.0 111.36 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.551 ' HD2' ' N ' ' A' ' 5' ' ' SER . 39.9 Cg_endo -66.4 108.6 1.41 Allowed 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 122.108 1.872 . . . . 0.0 111.975 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.478 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.5 OUTLIER -93.92 -48.42 6.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.244 -179.238 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.721 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 3.0 t -87.85 -34.79 18.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.717 -178.918 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.453 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.18 -36.1 74.74 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 177.406 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.8 t -70.21 -34.81 73.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.729 177.27 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.721 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 4.1 mtm -64.36 -35.34 80.56 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.823 177.633 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.753 HD11 ' HB3' ' A' ' 24' ' ' LEU . 3.8 mp -52.47 -51.21 60.49 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.994 178.769 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.96 -26.92 67.79 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.778 178.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.7 15.85 27.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.688 -178.797 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.883 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -134.51 56.14 16.98 Favored Pre-proline 0 CA--C 1.534 0.335 0 CA-C-O 120.546 0.212 . . . . 0.0 111.272 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.536 ' HD3' ' N ' ' A' ' 15' ' ' ALA . 48.4 Cg_exo -57.42 -49.69 12.98 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.68 2.253 . . . . 0.0 113.938 -178.592 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.446 ' HD3' ' HB2' ' A' ' 16' ' ' PRO . 22.9 Cg_exo -65.33 -161.04 0.04 OUTLIER 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 122.145 1.896 . . . . 0.0 112.501 -178.742 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -73.76 66.05 1.07 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.635 179.161 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.883 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 1.3 tp10 -104.6 9.65 35.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.782 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.604 HE22 ' HG2' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -47.72 -62.17 1.58 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.424 -178.423 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.85 ' HE3' ' HA ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER -55.73 -20.92 16.3 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.895 -177.049 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.642 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 23.5 tt0 -73.81 -80.3 0.08 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.013 0.435 . . . . 0.0 111.683 179.309 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.736 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -70.16 -96.84 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.04 0.755 . . . . 0.0 113.04 -176.453 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.753 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -57.69 0.83 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -175.422 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.587 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.86 -118.06 11.63 Favored Glycine 0 N--CA 1.446 -0.681 0 N-CA-C 108.349 -1.901 . . . . 0.0 108.349 -174.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.508 ' HG3' ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -76.07 -67.31 0.69 Allowed 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 168.713 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.73 ' HD3' HD12 ' A' ' 24' ' ' LEU . 0.3 OUTLIER -160.09 8.12 0.1 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.262 -1.335 . . . . 0.0 108.142 175.278 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 1.028 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.3 OUTLIER -59.28 -78.21 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.305 -1.316 . . . . 0.0 113.942 -173.656 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.637 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -33.67 -48.88 0.75 Allowed Pre-proline 0 CA--C 1.535 0.397 0 N-CA-C 113.758 1.022 . . . . 0.0 113.758 -175.147 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.613 ' HG3' ' HB2' ' A' ' 24' ' ' LEU . 18.9 Cg_endo -61.01 -42.86 33.63 Favored 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 122.137 1.891 . . . . 0.0 113.291 -178.052 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.72 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.36 -44.9 64.13 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 119.956 -0.698 . . . . 0.0 110.153 -179.566 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.725 HD11 HD23 ' A' ' 28' ' ' LEU . 0.5 OUTLIER -73.05 -14.46 16.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 CA-C-N 116.233 -0.44 . . . . 0.0 109.891 178.018 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.642 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 10.0 tp60 -62.41 -38.69 90.64 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 176.489 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.42 -30.12 69.79 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.327 -0.851 . . . . 0.0 108.939 174.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.596 ' HE2' ' HE ' ' A' ' 66' ' ' ARG . 6.8 mtt -102.18 26.28 7.87 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.209 177.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.642 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.9 p-80 -64.59 -32.08 6.57 Favored Pre-proline 0 CA--C 1.536 0.41 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 -177.102 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.586 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 44.4 Cg_exo -35.1 -34.06 0.1 OUTLIER 'Trans proline' 0 C--N 1.363 1.317 0 C-N-CA 122.24 1.96 . . . . 0.0 112.319 178.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.61 HG22 HD12 ' A' ' 76' ' ' LEU . 52.6 m -78.52 -87.61 0.06 Allowed 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.678 176.358 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.55 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 0.1 OUTLIER -171.47 63.78 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.49 178.102 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.511 ' HA ' HD12 ' A' ' 43' ' ' ILE . . . -47.96 -34.69 9.56 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 120.873 0.368 . . . . 0.0 111.622 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.637 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -51.5 -56.93 13.16 Favored Glycine 0 CA--C 1.518 0.23 0 CA-C-N 115.948 -0.569 . . . . 0.0 114.034 -178.379 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.6 ' HE2' ' SD ' ' A' ' 46' ' ' MET . 2.5 tptm -75.6 -35.65 60.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 117.034 0.417 . . . . 0.0 111.686 -177.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.661 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 41.2 mt -54.02 -59.48 2.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.139 -179.37 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . 1.028 ' HA ' HD22 ' A' ' 28' ' ' LEU . 11.0 t -47.82 -43.12 27.71 Favored 'General case' 0 CA--C 1.522 -0.129 0 CA-C-O 120.85 0.357 . . . . 0.0 110.444 178.863 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.696 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -48.23 -71.79 0.53 Allowed Glycine 0 N--CA 1.45 -0.396 0 CA-C-N 115.738 -0.665 . . . . 0.0 113.232 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.628 ' HE3' HG23 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -55.7 -43.41 76.44 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 117.035 0.417 . . . . 0.0 111.723 -178.399 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.519 ' CD1' ' HB2' ' B' ' 7' ' ' ASN . 3.1 mm? -79.84 5.64 13.15 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.682 0.253 . . . . 0.0 111.682 -178.517 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.64 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.17 -12.02 53.23 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.868 0.366 . . . . 0.0 110.605 179.627 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.449 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.1 mm-40 -78.0 17.65 0.57 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.364 177.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.419 ' HB ' ' O ' ' A' ' 47' ' ' LEU . 0.9 OUTLIER -83.45 159.46 3.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.1 -179.398 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.613 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 3.9 m-20 -71.01 151.1 44.96 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -178.064 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.806 ' HA ' HD23 ' A' ' 55' ' ' LEU . 2.2 t-20 -80.52 -30.51 37.19 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.679 177.016 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 39.6 m -73.99 -31.87 63.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.662 177.597 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.613 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 0.9 OUTLIER -76.55 -27.87 56.08 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.536 178.746 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.806 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -59.39 -48.73 80.51 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.355 179.841 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.468 ' HA ' HD22 ' A' ' 56' ' ' LEU . 0.9 OUTLIER -60.7 -43.61 97.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.551 179.614 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -59.59 -32.57 70.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.22 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.473 ' HB3' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -65.94 -45.41 81.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.324 -179.408 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.604 HD23 ' CG ' ' A' ' 27' ' ' ARG . 0.2 OUTLIER -67.15 -16.19 64.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.261 -179.524 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -98.79 -11.13 22.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.869 0.366 . . . . 0.0 110.915 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.59 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -123.68 86.48 52.85 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.864 179.859 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -60.35 -33.37 94.41 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.368 2.045 . . . . 0.0 112.216 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.598 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -77.98 -44.99 25.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.193 -179.723 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.598 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 14.5 m -73.83 -25.97 60.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.934 0.397 . . . . 0.0 111.051 -179.521 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.592 HD11 HD13 ' A' ' 31' ' ' LEU . 1.9 tp -78.76 -65.69 0.96 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.621 -178.896 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.596 ' HE ' ' HE2' ' A' ' 35' ' ' MET . 0.1 OUTLIER -51.4 -28.09 11.79 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.973 -178.0 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.576 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 28.7 t -69.42 -42.68 74.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.149 0.499 . . . . 0.0 110.094 178.129 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.655 ' HG2' HD21 ' B' ' 6' ' ' LEU . 2.5 ttmm -66.08 -57.22 8.2 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.55 179.278 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.542 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 52.9 t -64.11 -18.73 23.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.636 179.289 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.616 ' O ' HG22 ' A' ' 73' ' ' VAL . 21.9 t70 -55.65 -49.95 71.52 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 176.552 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.507 ' HB3' HD13 ' B' ' 6' ' ' LEU . 25.7 tt0 -68.53 -24.94 64.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.771 177.159 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.712 ' O ' HG22 ' A' ' 75' ' ' VAL . . . -63.26 -50.58 69.62 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.191 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.616 HG22 ' O ' ' A' ' 70' ' ' ASP . 3.7 m -58.15 -29.19 36.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 178.178 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.413 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -70.09 -36.75 75.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.083 179.004 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.712 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.3 m -59.67 -31.92 48.16 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.123 0 CA-C-O 121.078 0.466 . . . . 0.0 110.016 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.61 HD12 HG22 ' A' ' 38' ' ' THR . 2.4 tm? -71.91 -49.85 34.29 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.317 178.228 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -54.44 -39.82 67.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.51 179.479 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.48 -19.62 41.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.095 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.562 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 4.0 t60 -63.09 -55.92 21.28 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.016 -179.398 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -74.99 -10.26 59.31 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.961 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.42 -64.26 1.23 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.238 -179.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.75 -17.7 64.8 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.196 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.562 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 0.8 OUTLIER -74.51 -49.01 23.73 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.952 179.89 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -79.4 -8.94 59.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.942 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -79.71 -38.61 33.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.075 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -76.17 -169.5 1.17 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.822 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.82 -21.39 59.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.99 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -81.51 80.69 7.82 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.039 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -95.52 19.82 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.862 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -90.39 128.32 36.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.939 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 5.5 m -80.37 -73.29 0.37 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.016 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -92.01 -174.66 3.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.053 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 13.5 p -108.73 -6.16 16.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.986 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -101.16 -45.92 1.79 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.558 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 10.6 t -103.78 107.31 56.16 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-O 120.622 0.249 . . . . 0.0 111.101 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -70.08 -160.26 0.07 OUTLIER 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.556 2.171 . . . . 0.0 112.331 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.98 -172.09 3.93 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.938 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 21.7 t . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.059 -0.972 . . . . 0.0 111.055 179.967 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.795 0.331 . . . . 0.0 111.077 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 8.7 p -79.56 142.26 14.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.089 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.76 90.48 5.67 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.03 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 4' ' ' SER . . . . . 0.467 ' HB2' ' O ' ' B' ' 7' ' ' ASN . 0.0 OUTLIER -87.78 173.25 9.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.736 179.683 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 5' ' ' ASN . . . . . 0.503 ' HB2' HG12 ' A' ' 75' ' ' VAL . 62.5 m-20 -104.17 -72.23 0.71 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.291 -179.089 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.655 HD21 ' HG2' ' A' ' 68' ' ' LYS . 6.0 tp -62.43 -82.44 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.612 -179.778 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 7' ' ' ASN . . . . . 0.519 ' HB2' ' CD1' ' A' ' 47' ' ' LEU . 1.5 t-20 -75.22 136.46 72.42 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.651 178.665 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.72 -10.72 18.49 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 122.117 1.878 . . . . 0.0 111.819 178.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 9' ' ' ASN . . . . . 0.541 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 4.0 m120 -123.93 63.25 1.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.769 179.777 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 10' ' ' ALA . . . . . 0.474 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.15 92.06 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.561 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.541 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.2 OUTLIER -118.66 123.64 45.43 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.284 178.592 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 12' ' ' GLU . . . . . 0.514 ' HG2' ' HE3' ' A' ' 42' ' ' LYS . 8.5 mt-10 -47.97 172.14 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.251 0.548 . . . . 0.0 112.366 -178.149 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 13' ' ' PHE . . . . . 0.696 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.5 OUTLIER -87.42 79.94 8.27 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.799 179.088 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 14' ' ' VAL . . . . . 0.949 ' H ' ' HD2' ' B' ' 15' ' ' PRO . 1.2 m -113.42 -45.14 0.07 OUTLIER Pre-proline 0 CA--C 1.538 0.484 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -176.729 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 15' ' ' PRO . . . . . 0.949 ' HD2' ' H ' ' B' ' 14' ' ' VAL . 3.8 Cg_endo -46.75 -39.56 23.9 Favored 'Trans proline' 0 C--N 1.355 0.909 0 C-N-CA 122.425 2.083 . . . . 0.0 112.543 -178.808 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.68 -29.05 2.36 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.547 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.85 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.2 OUTLIER -94.92 -171.92 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 120.538 0.209 . . . . 0.0 110.689 179.77 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.604 ' HG2' HE22 ' A' ' 20' ' ' GLN . 4.3 mtmp? -60.01 93.79 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.879 0.371 . . . . 0.0 110.985 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -85.88 100.54 12.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.049 -179.648 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 91.54 76.65 1.33 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.458 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -95.5 13.31 26.46 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.785 0.326 . . . . 0.0 111.071 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.26 -0.876 . . . . 0.0 111.015 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.199 0 N-CA-C 112.41 -0.276 . . . . 0.0 112.41 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -70.97 112.88 3.4 Favored 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.586 2.191 . . . . 0.0 112.199 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.2 mp -91.63 164.11 13.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.904 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -103.61 112.27 4.15 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.783 -0.723 . . . . 0.0 112.55 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 56.9 p -76.52 137.59 67.33 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-O 120.529 0.204 . . . . 0.0 110.964 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -67.13 129.98 21.75 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.495 2.13 . . . . 0.0 112.185 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.463 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.8 OUTLIER -87.31 -74.73 0.43 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.052 -179.695 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.729 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 4.8 t -87.94 -28.84 21.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.552 -179.395 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.451 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.45 -39.02 82.26 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 177.167 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.14 -34.83 73.54 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.651 177.221 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.729 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 3.2 mtm -64.46 -34.78 78.99 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.765 177.545 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.646 HD21 ' NH1' ' A' ' 27' ' ' ARG . 1.9 mp -52.58 -52.18 56.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.111 178.631 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.88 -26.25 67.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.781 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -101.83 15.78 27.93 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.699 -179.005 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.98 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -134.11 55.78 16.54 Favored Pre-proline 0 CA--C 1.532 0.276 0 CA-C-N 116.71 -0.223 . . . . 0.0 111.446 -179.729 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.544 ' HD3' ' N ' ' A' ' 15' ' ' ALA . 46.5 Cg_exo -58.09 -49.46 12.6 Favored 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 122.726 2.284 . . . . 0.0 113.955 -178.771 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.464 ' HD2' ' N ' ' A' ' 16' ' ' PRO . 53.2 Cg_endo -68.52 -158.48 0.04 OUTLIER 'Trans proline' 0 C--N 1.354 0.852 0 C-N-CA 122.057 1.838 . . . . 0.0 112.484 -178.543 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.0 mm-40 -73.94 63.34 0.92 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.956 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.98 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 2.1 tp10 -104.55 14.62 29.62 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.817 -179.67 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.506 ' NE2' ' HE3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -53.47 -62.79 1.42 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.356 -179.468 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.576 ' HE3' ' HA ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER -55.63 -20.68 14.67 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.361 -178.079 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.691 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 13.9 tp60 -73.94 -78.63 0.09 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.04 0.448 . . . . 0.0 111.37 178.636 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.613 ' SD ' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.24 -96.35 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -176.665 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.589 ' HB2' ' CG ' ' A' ' 30' ' ' PRO . 0.4 OUTLIER -61.4 1.52 0.2 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -175.038 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.532 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 65.08 -117.18 9.86 Favored Glycine 0 N--CA 1.444 -0.794 0 N-CA-C 108.344 -1.903 . . . . 0.0 108.344 -174.3 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.425 ' O ' HD13 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -75.9 -66.81 0.74 Allowed 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 169.345 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.905 ' HG3' HD21 ' A' ' 31' ' ' LEU . 22.1 tpt180 -160.36 5.51 0.08 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.273 -1.33 . . . . 0.0 107.89 176.565 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.971 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.28 -74.6 0.07 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.169 -1.378 . . . . 0.0 114.394 -172.554 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.715 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.2 OUTLIER -33.17 -49.1 0.64 Allowed Pre-proline 0 CA--C 1.542 0.639 0 N-CA-C 113.256 0.835 . . . . 0.0 113.256 -175.204 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.589 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 38.0 Cg_exo -61.82 -40.15 46.94 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 122.513 2.142 . . . . 0.0 113.669 -178.845 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.976 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.13 -47.76 60.36 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 -179.347 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.646 HD11 HD23 ' A' ' 28' ' ' LEU . 0.5 OUTLIER -73.1 -13.2 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.637 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.878 177.478 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.654 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 45.7 tt0 -62.41 -41.04 98.38 Favored 'General case' 0 CA--C 1.518 -0.256 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 177.594 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.85 -29.97 70.02 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 175.249 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.533 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 4.7 mtt -101.75 26.19 7.72 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.23 178.191 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.654 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 3.2 p-80 -62.38 -32.76 10.07 Favored Pre-proline 0 CA--C 1.537 0.479 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -176.793 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.558 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 55.0 Cg_exo -36.43 -30.78 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.282 0 C-N-CA 122.151 1.901 . . . . 0.0 112.211 179.171 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.799 HG21 HG13 ' A' ' 73' ' ' VAL . 3.5 m -78.21 -89.13 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.73 176.474 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.518 HD12 ' H ' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -171.51 59.44 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.168 177.975 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.467 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -43.57 -39.47 3.49 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.6 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.6 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.83 -56.49 9.83 Favored Glycine 0 C--N 1.329 0.186 0 CA-C-N 116.044 -0.525 . . . . 0.0 113.818 -179.186 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.643 ' HE2' ' SD ' ' A' ' 46' ' ' MET . 2.8 tptm -77.46 -37.48 51.36 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 -178.048 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.644 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 45.7 mt -53.74 -57.0 6.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.007 -178.77 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.971 ' HA ' HD22 ' A' ' 28' ' ' LEU . 9.8 t -49.25 -40.25 33.41 Favored 'General case' 0 N--CA 1.457 -0.115 0 CA-C-O 121.006 0.432 . . . . 0.0 110.073 177.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.752 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -50.33 -68.68 1.33 Allowed Glycine 0 N--CA 1.45 -0.426 0 CA-C-N 115.572 -0.74 . . . . 0.0 112.927 179.635 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.643 ' SD ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.19 -46.4 75.85 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -178.5 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.526 HD12 ' HB2' ' B' ' 7' ' ' ASN . 2.8 mm? -80.23 7.29 9.72 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 111.698 0.259 . . . . 0.0 111.698 -179.063 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.631 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.23 -13.24 60.03 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.9 0.381 . . . . 0.0 110.637 179.585 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.546 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 3.3 mt-10 -78.3 19.28 0.46 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.484 178.252 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.864 HD11 ' NZ ' ' A' ' 68' ' ' LYS . 2.3 tt -83.12 163.5 2.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.02 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.685 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 3.6 m-20 -71.12 158.95 35.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.731 -179.418 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.771 ' HA ' HD23 ' A' ' 55' ' ' LEU . 4.8 m120 -88.41 -29.08 20.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.837 -0.619 . . . . 0.0 109.676 176.788 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.91 -30.36 62.55 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 177.025 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.685 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 0.4 OUTLIER -76.93 -29.2 55.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.522 178.675 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.771 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -59.32 -47.49 85.2 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.986 0.422 . . . . 0.0 110.364 179.777 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.444 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 1.3 tm? -60.7 -41.65 95.62 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.474 179.213 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.538 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 0.2 OUTLIER -61.69 -41.8 98.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.615 179.101 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.59 ' HE2' ' HA ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -62.09 -36.72 82.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.128 178.749 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.783 HD12 ' NE ' ' A' ' 27' ' ' ARG . 4.4 tt -71.09 -19.79 62.42 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.407 178.723 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.538 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 2.6 pt-20 -106.01 -2.46 22.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.148 -179.64 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.59 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 9.1 m -123.16 78.87 52.23 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.933 -179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -55.79 -36.47 95.31 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.124 1.883 . . . . 0.0 112.059 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.459 ' HG2' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.7 -46.6 18.68 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.883 -179.065 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.59 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 14.1 m -71.15 -50.46 33.18 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.952 0.406 . . . . 0.0 111.311 -178.008 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.976 HD21 HD13 ' A' ' 31' ' ' LEU . 0.0 OUTLIER -57.95 -56.9 16.05 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.874 -179.242 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.639 ' N ' HD13 ' A' ' 65' ' ' LEU . 2.2 ttm180 -51.56 -30.78 22.03 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.744 -178.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.502 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 5.9 t -69.66 -38.54 77.14 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.031 0.444 . . . . 0.0 110.327 178.322 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.864 ' NZ ' HD11 ' A' ' 50' ' ' ILE . 8.7 mtpp -65.41 -58.55 5.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.189 178.9 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.46 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 49.5 t -62.75 -21.58 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.616 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.502 ' HB3' ' O ' ' A' ' 67' ' ' SER . 13.4 t0 -54.46 -48.97 71.14 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 177.089 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.436 ' O ' HG13 ' A' ' 75' ' ' VAL . 21.6 tt0 -68.76 -32.62 72.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.602 176.725 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.644 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -58.29 -35.32 71.63 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.393 178.217 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.799 HG13 HG21 ' A' ' 38' ' ' THR . 25.3 t -67.0 -33.02 60.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.662 177.613 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.35 -38.01 71.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.123 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.58 HG22 ' O ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -56.78 -33.38 40.81 Favored 'Isoleucine or valine' 0 C--O 1.231 0.092 0 CA-C-O 121.187 0.517 . . . . 0.0 109.916 179.17 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.744 HD12 HG22 ' A' ' 38' ' ' THR . 2.9 tm? -69.37 -49.87 51.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.525 178.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -54.14 -35.44 62.23 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.601 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.0 -26.85 36.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.705 178.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.512 ' O ' ' HB3' ' A' ' 83' ' ' GLU . 5.0 t60 -67.3 -62.55 1.37 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.797 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -63.41 -13.41 39.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.08 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -72.53 -57.72 3.93 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.063 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 1.4 mmtt -79.47 -16.1 56.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.879 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.512 ' HB3' ' O ' ' A' ' 79' ' ' HIS . 1.5 tt0 -79.73 -48.84 12.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.791 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -70.22 -10.29 58.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.205 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.71 -58.4 6.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.127 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -93.82 142.61 27.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.907 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.31 -6.22 56.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.983 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -87.43 100.58 12.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.97 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -103.51 177.17 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.98 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -94.54 135.17 36.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.942 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.57 116.57 12.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.85 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.31 132.71 38.75 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.093 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -118.67 31.3 6.73 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.822 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -96.39 77.52 0.74 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.605 -179.787 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.539 ' N ' ' HD2' ' A' ' 96' ' ' PRO . 61.8 t -86.67 -51.27 0.45 Allowed Pre-proline 0 C--N 1.329 -0.292 0 N-CA-C 111.416 0.154 . . . . 0.0 111.416 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.539 ' HD2' ' N ' ' A' ' 95' ' ' VAL . 38.1 Cg_endo -66.0 -29.73 48.58 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.114 1.876 . . . . 0.0 112.135 179.785 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -106.96 104.17 13.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.933 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 7.3 t . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.028 -0.987 . . . . 0.0 111.009 179.949 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 11.2 t . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.833 0.349 . . . . 0.0 110.934 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 2' ' ' VAL . . . . . 0.415 ' CG1' ' HB3' ' B' ' 10' ' ' ALA . 3.9 t -90.94 87.8 2.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.059 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 5.7 tttp -86.77 54.03 3.03 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.815 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 4' ' ' SER . . . . . 0.641 ' HB3' ' HB2' ' B' ' 10' ' ' ALA . 1.1 p -84.91 132.85 34.32 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.018 -179.688 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -105.23 -46.78 4.14 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.702 179.461 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.439 HD12 ' HA ' ' B' ' 6' ' ' LEU . 3.3 tp -70.84 -83.23 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.601 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 7' ' ' ASN . . . . . 0.526 ' HB2' HD12 ' A' ' 47' ' ' LEU . 1.5 t-20 -76.02 134.43 71.35 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.694 178.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -79.87 -8.32 14.46 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 122.327 2.018 . . . . 0.0 112.305 179.732 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 9' ' ' ASN . . . . . 0.419 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 73.9 m-20 -123.67 57.46 1.18 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.012 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 10' ' ' ALA . . . . . 0.641 ' HB2' ' HB3' ' B' ' 4' ' ' SER . . . -60.15 95.88 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.379 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.546 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -125.01 131.82 53.34 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.585 179.004 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -47.66 167.68 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 121.2 0.524 . . . . 0.0 112.301 -178.366 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 13' ' ' PHE . . . . . 0.752 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.6 OUTLIER -87.11 83.55 7.43 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.69 179.126 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 14' ' ' VAL . . . . . 0.595 ' H ' ' HD2' ' B' ' 15' ' ' PRO . 3.3 t -116.55 -50.63 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.343 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -176.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 15' ' ' PRO . . . . . 0.595 ' HD2' ' H ' ' B' ' 14' ' ' VAL . 98.8 Cg_exo -44.48 -36.73 10.12 Favored 'Trans proline' 0 C--N 1.353 0.771 0 C-N-CA 122.327 2.018 . . . . 0.0 112.791 -178.547 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 16' ' ' GLY . . . . . 0.533 ' O ' ' HB2' ' A' ' 21' ' ' LYS . . . 76.48 -20.06 2.87 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.472 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.576 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 27.7 m -96.99 -171.46 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.546 0.212 . . . . 0.0 110.662 179.492 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.506 ' HE3' ' NE2' ' A' ' 20' ' ' GLN . 3.6 mttp -60.21 91.45 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.822 0.344 . . . . 0.0 110.84 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.405 ' HD1' ' HA ' ' B' ' 19' ' ' TYR . 0.1 OUTLIER -80.25 129.8 34.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.841 -179.933 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 92.19 17.49 46.65 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.363 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 60.8 t30 -86.69 52.92 2.64 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.907 0.384 . . . . 0.0 110.872 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 1.5 pt . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.137 -179.949 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.191 0 CA-C-O 120.137 -0.257 . . . . 0.0 112.535 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -72.29 -37.89 4.1 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.519 2.146 . . . . 0.0 112.39 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.26 106.26 12.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.034 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -81.54 80.41 1.74 Allowed Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.399 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.568 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 18.5 t -87.93 -50.46 0.42 Allowed Pre-proline 0 CA--C 1.533 0.305 0 N-CA-C 111.559 0.207 . . . . 0.0 111.559 -179.727 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.568 ' HD2' ' N ' ' A' ' 5' ' ' SER . 33.6 Cg_endo -64.24 -31.12 64.12 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 122.215 1.944 . . . . 0.0 112.289 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.442 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.3 OUTLIER -96.68 119.14 34.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.078 -179.763 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.782 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 5.2 t -88.0 -30.11 20.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.336 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.14 -37.07 76.37 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 176.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 17.3 t -70.1 -35.92 74.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.566 177.01 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.782 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 8.7 mtm -64.43 -35.52 81.19 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.129 177.732 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.558 ' HA ' ' HE2' ' A' ' 23' ' ' MET . 44.7 mt -52.71 -50.19 63.85 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.915 179.054 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.18 -28.83 69.06 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.875 177.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -101.76 23.92 10.63 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.931 -178.537 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.637 ' HB1' ' CB ' ' A' ' 19' ' ' GLU . . . -134.32 60.92 46.89 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 120.626 0.251 . . . . 0.0 110.851 179.427 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.496 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 51.8 Cg_exo -56.64 -50.53 11.48 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 122.742 2.295 . . . . 0.0 113.86 -178.237 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.496 ' HD3' ' HB2' ' A' ' 16' ' ' PRO . 20.0 Cg_exo -65.81 -165.24 0.08 OUTLIER 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 121.98 1.787 . . . . 0.0 112.274 -179.04 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -74.23 62.03 0.91 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.587 178.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.637 ' CB ' ' HB1' ' A' ' 15' ' ' ALA . 1.9 mm-40 -93.81 5.74 50.67 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.086 -179.003 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.516 ' O ' HD12 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -46.9 -56.49 6.25 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.412 -177.917 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.948 ' HD2' ' HA ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER -56.15 -29.02 60.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.176 -179.163 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 14.9 tp60 -72.65 -73.86 0.19 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.483 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.594 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.41 -97.87 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -176.926 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.686 HD22 ' HD3' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -62.22 3.65 0.17 Allowed 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -174.914 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.5 -118.7 13.22 Favored Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 108.274 -1.931 . . . . 0.0 108.274 -174.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.624 ' HG2' HG22 ' A' ' 50' ' ' ILE . 0.4 OUTLIER -75.59 -66.37 0.79 Allowed 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 106.962 -1.496 . . . . 0.0 106.962 168.105 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.686 ' HD3' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -159.81 5.99 0.09 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.009 -1.45 . . . . 0.0 108.0 174.164 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.902 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.4 OUTLIER -59.64 -77.62 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.271 -1.331 . . . . 0.0 114.354 -173.061 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.576 ' CD2' HG21 ' A' ' 44' ' ' THR . 0.1 OUTLIER -33.15 -48.45 0.61 Allowed Pre-proline 0 CA--C 1.539 0.538 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -174.636 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.586 ' HD3' ' HA ' ' A' ' 24' ' ' LEU . 19.2 Cg_endo -62.13 -43.45 24.09 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.22 1.947 . . . . 0.0 113.448 -178.463 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.805 HD13 HG21 ' A' ' 69' ' ' VAL . 0.0 OUTLIER -71.32 -44.62 64.77 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 119.816 -0.754 . . . . 0.0 109.984 -179.645 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.576 HD11 HD23 ' A' ' 28' ' ' LEU . 0.5 OUTLIER -72.23 -13.34 16.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 177.689 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.641 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 57.7 tp60 -62.53 -41.75 99.07 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 176.826 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.83 -28.03 68.03 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 175.085 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.524 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 5.9 mtt -102.75 25.4 9.26 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.228 178.291 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.641 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 2.2 p-80 -64.39 -31.69 6.23 Favored Pre-proline 0 CA--C 1.536 0.421 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -176.526 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.561 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 51.8 Cg_exo -36.11 -31.74 0.1 OUTLIER 'Trans proline' 0 C--N 1.363 1.318 0 C-N-CA 122.125 1.884 . . . . 0.0 112.061 179.136 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.802 HG21 HG13 ' A' ' 73' ' ' VAL . 6.9 m -78.21 -88.92 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.578 176.144 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.616 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 7.7 tp -171.7 62.64 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.131 177.371 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.487 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -45.02 -41.2 7.22 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.544 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.526 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -52.17 -51.62 40.4 Favored Glycine 0 C--N 1.329 0.192 0 C-N-CA 121.172 -0.537 . . . . 0.0 113.587 -179.222 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.46 ' HA ' ' HD2' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -77.42 -40.44 43.49 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 122.719 -0.283 . . . . 0.0 111.68 -178.594 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.64 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 65.7 mt -53.7 -54.53 18.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.83 -179.733 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.902 ' HA ' HD22 ' A' ' 28' ' ' LEU . 11.4 t -53.47 -41.26 66.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.362 178.918 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.647 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -51.62 -67.45 1.99 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 121.009 -0.615 . . . . 0.0 112.85 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.557 ' HG3' HD22 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -55.35 -47.0 76.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.712 0.256 . . . . 0.0 111.575 -179.022 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.557 HD22 ' HG3' ' A' ' 46' ' ' MET . 3.1 mm? -80.28 8.23 7.85 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.625 0.231 . . . . 0.0 111.625 -179.216 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.647 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.1 OUTLIER -64.54 -13.26 51.81 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 121.017 0.437 . . . . 0.0 110.111 179.406 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.483 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.5 mt-10 -78.67 20.64 0.43 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.377 177.211 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.624 HG22 ' HG2' ' A' ' 26' ' ' GLU . 0.3 OUTLIER -83.26 157.03 3.79 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.672 -179.457 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.65 155.47 40.46 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.905 0.383 . . . . 0.0 111.745 -178.278 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.895 ' HA ' HD23 ' A' ' 55' ' ' LEU . 7.2 m-80 -85.61 -28.98 24.45 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.06 177.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 62.6 m -74.19 -29.96 62.0 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.721 177.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.566 ' O ' ' HG2' ' A' ' 58' ' ' MET . 2.6 mm-40 -79.88 -29.39 39.96 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.638 179.062 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.895 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -58.99 -46.88 87.05 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.132 179.757 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.458 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 26.9 tp -62.16 -45.55 92.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.617 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -59.62 -28.49 67.26 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.17 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.629 ' SD ' ' HA ' ' A' ' 65' ' ' LEU . 32.1 mmt -69.51 -49.05 58.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.377 -179.375 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.528 ' HG ' ' CZ ' ' A' ' 27' ' ' ARG . 0.2 OUTLIER -64.38 -21.23 66.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.092 -179.576 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -96.38 -4.56 41.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.062 0.458 . . . . 0.0 110.41 178.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.58 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 11.9 m -124.18 78.39 59.96 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.803 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -55.79 -33.73 88.99 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.138 1.892 . . . . 0.0 112.146 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -78.13 -49.44 13.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.828 -179.374 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.58 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 39.2 m -69.45 -45.38 69.21 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.853 0.359 . . . . 0.0 111.444 -178.272 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.658 HD11 HD13 ' A' ' 31' ' ' LEU . 0.6 OUTLIER -57.92 -66.72 0.43 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.409 -178.835 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.65 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -47.06 -31.47 3.38 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.924 -178.884 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.529 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.5 OUTLIER -65.36 -44.27 88.18 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.164 0.507 . . . . 0.0 109.986 177.714 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.512 ' O ' HD11 ' B' ' 6' ' ' LEU . 0.2 OUTLIER -65.86 -59.85 3.45 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.555 178.791 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.805 HG21 HD13 ' A' ' 31' ' ' LEU . 78.8 t -61.05 -19.67 20.46 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.018 179.608 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.529 ' HB3' ' O ' ' A' ' 67' ' ' SER . 7.1 t70 -55.7 -49.42 73.06 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 176.174 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.458 ' O ' HG13 ' A' ' 75' ' ' VAL . 22.2 tt0 -66.12 -32.53 74.03 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.677 176.239 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.65 ' O ' HG22 ' A' ' 75' ' ' VAL . . . -57.74 -37.07 72.97 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.31 178.639 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.802 HG13 HG21 ' A' ' 38' ' ' THR . 24.6 t -65.04 -32.57 58.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.642 177.465 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.05 -36.62 66.93 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.205 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.65 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.85 -29.45 40.49 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.129 0 CA-C-O 121.02 0.438 . . . . 0.0 110.098 179.111 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.633 HD12 HG22 ' A' ' 38' ' ' THR . 2.6 tm? -70.34 -51.01 33.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.375 178.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -58.06 -35.54 71.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.457 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.27 -17.91 47.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.006 179.13 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.518 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 56.9 t-80 -69.55 -61.43 1.79 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.966 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -64.79 -24.83 67.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.073 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -72.7 -54.16 9.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.2 -179.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.77 -18.13 62.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.111 -179.448 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.518 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 2.4 tp10 -80.16 -50.99 9.51 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.924 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -68.78 -25.96 64.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.082 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -84.19 25.46 0.84 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.262 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.416 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 2.5 mm-40 -89.18 34.57 0.8 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.861 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.2 mtmp? -85.41 115.95 23.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.931 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -89.71 9.04 28.64 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.052 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 14.1 p -88.43 -26.22 5.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.996 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -82.11 120.24 25.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.899 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.4 m -81.05 -77.45 0.21 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.893 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -92.71 147.25 23.02 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.043 179.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -116.39 89.5 3.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.994 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -98.32 64.29 0.81 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.366 179.891 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 16.5 t -105.51 100.81 28.35 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 120.657 0.265 . . . . 0.0 111.087 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -74.57 -170.06 0.69 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.512 2.142 . . . . 0.0 112.291 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -107.22 -78.44 0.58 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.001 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 7.1 p . . . . . 0 C--O 1.249 1.078 0 CA-C-O 117.987 -1.006 . . . . 0.0 111.054 -179.886 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 2.8 m . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.873 0.368 . . . . 0.0 111.091 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 12.1 p -83.36 146.95 6.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.043 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 4.9 mtpp -95.31 89.09 5.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.895 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 4' ' ' SER . . . . . 0.456 ' HB2' ' O ' ' B' ' 7' ' ' ASN . 0.9 OUTLIER -81.6 -161.91 0.47 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.893 -179.815 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 5' ' ' ASN . . . . . 0.593 ' HB2' HG12 ' A' ' 75' ' ' VAL . 2.6 m-80 -104.07 -83.37 0.49 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.914 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.512 HD11 ' O ' ' A' ' 68' ' ' LYS . 3.4 mt -62.72 -80.18 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.583 179.572 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 7' ' ' ASN . . . . . 0.456 ' O ' ' HB2' ' B' ' 4' ' ' SER . 1.6 t-20 -75.02 142.34 75.95 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.556 178.853 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -78.98 -12.18 14.71 Favored 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.318 2.012 . . . . 0.0 112.122 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 9' ' ' ASN . . . . . 0.585 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 69.9 m-20 -123.96 60.72 1.11 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.163 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.86 96.11 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.616 179.535 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.585 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.0 OUTLIER -122.47 129.05 51.61 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.37 178.433 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -48.17 173.44 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.115 0.483 . . . . 0.0 112.126 -178.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 13' ' ' PHE . . . . . 0.483 ' CE1' ' HG ' ' A' ' 48' ' ' LEU . 0.3 OUTLIER -86.92 90.38 8.31 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.867 179.393 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 14' ' ' VAL . . . . . 0.948 ' H ' ' HD2' ' B' ' 15' ' ' PRO . 0.5 OUTLIER -119.51 -47.63 0.04 OUTLIER Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.798 -176.902 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 15' ' ' PRO . . . . . 0.948 ' HD2' ' H ' ' B' ' 14' ' ' VAL . 9.8 Cg_endo -51.07 -39.71 60.16 Favored 'Trans proline' 0 C--N 1.353 0.777 0 C-N-CA 122.201 1.934 . . . . 0.0 112.582 -178.816 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 16' ' ' GLY . . . . . 0.404 ' O ' ' HB2' ' A' ' 21' ' ' LYS . . . 78.44 -23.64 2.81 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.384 -179.672 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.948 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 1.9 p -94.97 -174.1 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 110.351 -0.24 . . . . 0.0 110.351 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.725 ' H ' HG22 ' B' ' 17' ' ' VAL . 7.6 mttt -59.89 88.71 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.89 0.376 . . . . 0.0 110.63 179.783 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -81.04 112.8 18.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.941 -179.324 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 87.69 54.91 2.4 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.514 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -96.57 83.19 3.45 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.876 0.369 . . . . 0.0 110.819 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 1.7 mt . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.311 -0.852 . . . . 0.0 111.05 -179.929 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.186 0 N-CA-C 112.533 -0.227 . . . . 0.0 112.533 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -67.69 98.56 0.5 Allowed 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.591 2.194 . . . . 0.0 112.214 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.7 8.37 20.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.016 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -94.54 20.5 48.05 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.32 179.658 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.69 ' N ' ' HA ' ' A' ' 6' ' ' PRO . 0.7 OUTLIER -83.49 -38.77 0.73 Allowed Pre-proline 0 CA--C 1.537 0.479 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -179.447 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.69 ' HA ' ' N ' ' A' ' 5' ' ' SER . 10.3 Cg_exo -71.6 -57.24 0.14 OUTLIER 'Cis proline' 0 C--N 1.359 1.086 0 CA-C-N 119.738 0.942 . . . . 0.0 112.974 -0.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.458 ' O ' ' HB2' ' A' ' 5' ' ' SER . 1.9 mt -98.14 -168.28 1.63 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.263 -178.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.849 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 10.8 t -87.68 -29.76 20.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.473 -179.507 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.435 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.45 -37.2 77.55 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 176.718 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.3 t -70.56 -33.77 71.48 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.591 177.01 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.849 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.3 mtm -64.09 -35.74 81.75 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 177.676 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.559 HD11 ' HB3' ' A' ' 24' ' ' LEU . 1.7 mp -52.32 -54.27 33.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.02 178.637 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.31 -26.68 67.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.244 178.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.7 p -101.64 15.57 28.51 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.881 -178.267 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.674 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -134.96 125.05 16.97 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 120.583 0.23 . . . . 0.0 111.209 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -62.8 169.73 8.28 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.456 2.104 . . . . 0.0 111.645 179.137 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.451 ' O ' ' HG3' ' A' ' 20' ' ' GLN . 17.0 Cg_endo -57.15 -33.04 95.12 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.384 2.056 . . . . 0.0 112.061 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.83 -7.15 51.12 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.306 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.674 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -91.42 19.26 6.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.947 -179.624 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.517 ' NE2' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -54.24 -65.47 0.57 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.265 -179.55 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.618 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -56.34 -19.59 15.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.733 -177.693 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.618 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 16.6 tp60 -72.72 -80.59 0.06 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.028 0.442 . . . . 0.0 111.322 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.663 ' HE2' ' HB3' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -69.91 -95.41 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.658 -177.374 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.582 ' HB2' ' CG ' ' A' ' 30' ' ' PRO . 0.4 OUTLIER -62.46 -2.38 1.04 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -175.06 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.561 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 65.29 -116.35 8.71 Favored Glycine 0 N--CA 1.445 -0.763 0 N-CA-C 108.419 -1.872 . . . . 0.0 108.419 -173.77 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.65 -69.88 0.49 Allowed 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 169.407 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.699 ' HD2' ' HG2' ' A' ' 30' ' ' PRO . 12.8 tpt180 -160.11 14.33 0.13 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.325 -1.307 . . . . 0.0 107.951 175.876 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.556 ' O ' HG13 ' A' ' 32' ' ' ILE . 3.9 mm? -57.76 -76.2 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.423 -1.262 . . . . 0.0 113.329 -174.281 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.634 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -39.02 -47.11 3.68 Favored Pre-proline 0 CA--C 1.538 0.517 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -175.815 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.699 ' HG2' ' HD2' ' A' ' 27' ' ' ARG . 52.1 Cg_exo -57.36 -43.31 53.2 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.333 2.022 . . . . 0.0 113.817 -178.145 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.881 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.58 -47.44 60.24 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.395 0.617 . . . . 0.0 109.955 -178.488 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.771 HG21 HD12 ' A' ' 43' ' ' ILE . 0.7 OUTLIER -73.99 -13.15 15.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.227 178.468 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.647 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 3.6 tm0? -62.54 -40.85 98.1 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 176.834 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.13 -30.06 70.47 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 174.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.486 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 6.6 mtt -101.69 25.93 7.96 Favored 'General case' 0 N--CA 1.461 0.09 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.443 178.199 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.647 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.8 p-80 -65.32 -32.87 6.85 Favored Pre-proline 0 CA--C 1.535 0.392 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 -177.329 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.573 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 57.3 Cg_exo -36.69 -33.01 0.13 Allowed 'Trans proline' 0 C--N 1.36 1.181 0 C-N-CA 122.183 1.922 . . . . 0.0 112.182 179.407 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.473 ' HB ' ' H ' ' A' ' 39' ' ' LEU . 1.1 m -79.06 -86.31 0.07 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.982 -0.553 . . . . 0.0 109.732 176.573 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.599 ' HB2' HD13 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -171.36 65.03 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.194 0 CA-C-O 120.719 0.295 . . . . 0.0 111.371 177.982 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.543 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -52.62 -29.1 24.24 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.127 179.165 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.62 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -49.49 -56.83 10.24 Favored Glycine 0 N--CA 1.452 -0.234 0 CA-C-N 115.805 -0.634 . . . . 0.0 114.053 -178.38 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.609 ' O ' ' HG2' ' A' ' 46' ' ' MET . 0.0 OUTLIER -77.93 -37.99 46.47 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -177.345 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.792 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 22.0 mt -53.18 -54.19 18.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 C-N-CA 120.952 -0.299 . . . . 0.0 111.562 -177.719 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.542 HG21 ' CD2' ' A' ' 29' ' ' PHE . 5.1 t -46.8 -49.46 19.89 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.44 ' N ' HG23 ' A' ' 44' ' ' THR . . . -55.16 -48.56 67.56 Favored Glycine 0 N--CA 1.449 -0.451 0 CA-C-N 115.878 -0.601 . . . . 0.0 112.796 178.615 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.716 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.2 OUTLIER -54.94 -69.78 0.12 Allowed 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.461 0.648 . . . . 0.0 111.066 -179.079 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.855 HD23 ' HB2' ' B' ' 7' ' ' ASN . 2.5 mp -80.03 17.64 0.96 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.832 -177.142 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.592 ' HB3' ' HD2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -65.98 -23.47 66.59 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 121.161 0.505 . . . . 0.0 109.755 177.009 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.547 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 1.2 mt-10 -74.58 23.46 0.09 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.01 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.625 HD11 ' HE3' ' A' ' 68' ' ' LYS . 3.5 tt -84.7 169.52 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.932 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.541 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 30.6 m-20 -70.96 159.59 34.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.615 -179.569 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.85 ' HA ' HD23 ' A' ' 55' ' ' LEU . 26.3 m-80 -89.09 -28.31 20.19 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.897 177.232 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -74.05 -30.15 62.26 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 177.144 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.541 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 1.2 mm-40 -78.87 -28.77 44.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.656 178.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.85 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -59.18 -45.93 89.73 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.07 179.6 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.53 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 7.1 tt -60.1 -49.97 75.54 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.6 179.022 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -58.59 -32.05 68.61 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.284 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.565 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -62.85 -55.62 24.66 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.067 -179.77 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 56' ' ' LEU . 2.3 pp -66.14 -6.21 12.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.028 0.442 . . . . 0.0 110.369 178.62 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.522 ' O ' ' HG3' ' A' ' 60' ' ' GLU . 9.4 tp10 -105.12 -13.95 15.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.606 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.534 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -122.66 91.37 49.56 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.966 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.408 ' HD2' ' HA ' ' A' ' 61' ' ' SER . 32.2 Cg_endo -63.79 -31.25 68.57 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.303 2.002 . . . . 0.0 112.151 179.537 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.573 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.61 -45.44 21.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.15 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.573 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 19.1 m -72.73 -56.36 5.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.011 0.434 . . . . 0.0 111.537 -178.633 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.881 HD21 HD13 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -57.86 -60.69 3.32 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.621 -177.999 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.703 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -51.78 -35.41 43.72 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.22 -177.752 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.533 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 2.8 m -65.52 -37.76 87.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.102 0.477 . . . . 0.0 110.194 178.23 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.625 ' HE3' HD11 ' A' ' 50' ' ' ILE . 0.5 OUTLIER -66.39 -55.08 17.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.574 179.019 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.626 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 61.4 t -67.99 -16.14 20.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.564 179.504 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.588 ' O ' HG22 ' A' ' 73' ' ' VAL . 8.7 t70 -58.04 -49.46 76.8 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 176.101 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.529 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 0.4 OUTLIER -68.9 -20.07 64.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.734 176.354 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.792 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -65.63 -47.72 74.64 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.732 179.434 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.588 HG22 ' O ' ' A' ' 70' ' ' ASP . 2.4 m -57.17 -30.5 34.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 176.62 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.529 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -68.33 -32.18 72.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.837 178.403 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.682 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.2 m -60.81 -30.91 48.17 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.131 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 178.926 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.599 HD13 ' HB2' ' A' ' 39' ' ' LEU . 30.6 mt -67.82 -50.55 56.11 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.271 0.557 . . . . 0.0 109.602 176.276 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -51.53 -39.18 57.21 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.343 179.099 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 82' ' ' LYS . . . -81.93 -25.11 35.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.848 177.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.432 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 11.9 t-160 -71.27 -25.47 62.47 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.956 -179.557 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -83.59 -39.57 20.17 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.86 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -73.51 -37.96 65.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.433 -179.186 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.445 ' HB2' ' O ' ' A' ' 78' ' ' ALA . 3.0 mptm? -73.37 -27.6 61.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.151 -179.29 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.448 ' O ' ' HB2' ' A' ' 87' ' ' LYS . 8.8 tt0 -87.03 -21.4 26.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.006 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -80.09 11.32 3.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.378 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -82.33 -68.33 0.71 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.23 -179.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -81.28 3.81 22.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.067 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.448 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.4 tttm -87.71 127.63 35.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.847 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -83.98 81.21 8.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.989 179.706 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.6 t -80.15 78.37 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.987 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 31.8 m120 -93.78 97.07 10.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.906 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 27.0 m -83.05 4.56 25.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.914 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.78 96.64 2.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.015 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 12.9 p -92.95 -68.91 0.77 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.915 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -86.11 -117.88 0.99 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.532 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.2 t -81.36 126.61 76.07 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 120.581 0.229 . . . . 0.0 111.086 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -68.86 92.82 0.44 Allowed 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.469 2.112 . . . . 0.0 112.287 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.2 p -89.18 -56.86 3.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.972 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 14.9 p . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.109 -0.948 . . . . 0.0 111.171 -179.926 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 7.2 p . . . . . 0 N--CA 1.485 1.311 0 CA-C-O 120.853 0.359 . . . . 0.0 111.04 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 20.0 t -99.67 108.02 21.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.064 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 21.4 tttt -85.25 112.34 20.67 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.814 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -89.65 -175.49 4.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.038 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -104.96 -36.89 7.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.981 179.792 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.616 ' HB3' HD21 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -82.78 -79.0 0.2 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.818 179.678 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 7' ' ' ASN . . . . . 0.855 ' HB2' HD23 ' A' ' 47' ' ' LEU . 1.5 t-20 -84.98 127.63 63.76 Favored Pre-proline 0 C--N 1.331 -0.219 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.129 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -80.17 13.48 2.19 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 122.357 2.038 . . . . 0.0 111.884 178.436 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 9' ' ' ASN . . . . . 0.526 ' HB3' ' OE2' ' A' ' 49' ' ' GLU . 25.8 m-20 -123.61 28.31 7.02 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.31 -179.501 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 10' ' ' ALA . . . . . 0.716 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -59.39 96.41 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.818 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.547 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 1.7 mttp -130.11 -178.4 4.72 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.473 178.682 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -68.87 161.34 28.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.658 0.266 . . . . 0.0 111.061 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 13' ' ' PHE . . . . . 0.431 ' O ' ' HD3' ' B' ' 15' ' ' PRO . 1.0 OUTLIER -88.42 111.15 21.45 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.957 0.408 . . . . 0.0 110.697 179.427 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -112.39 88.79 11.36 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.399 178.614 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 15' ' ' PRO . . . . . 0.431 ' HD3' ' O ' ' B' ' 13' ' ' PHE . 51.9 Cg_exo -55.06 -176.39 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.814 2.342 . . . . 0.0 112.842 -178.535 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.01 -40.93 3.02 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.522 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 17.1 m -115.45 149.85 17.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.798 0.332 . . . . 0.0 111.301 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 24.0 mttp -74.78 93.05 2.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.516 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.592 ' HD2' ' HB3' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -65.02 118.42 9.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.983 -179.449 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 91.0 31.83 9.52 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.548 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 14.8 t30 -100.66 -0.19 37.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.843 0.354 . . . . 0.0 110.976 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 2.1 tp . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.255 -0.878 . . . . 0.0 111.007 -179.945 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 112.414 -0.275 . . . . 0.0 112.414 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -80.49 51.46 3.93 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.678 2.252 . . . . 0.0 112.409 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.6 mp -77.89 -44.68 26.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.873 179.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -104.42 -33.53 3.88 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.379 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 34.0 t -80.95 121.59 80.99 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 120.545 0.212 . . . . 0.0 110.871 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.47 ' HB2' ' HB3' ' A' ' 9' ' ' ALA . 47.6 Cg_endo -68.18 147.69 73.32 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.524 2.15 . . . . 0.0 112.233 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.445 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.2 OUTLIER -100.96 -35.73 9.28 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.368 -179.284 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.797 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 8.0 t -87.77 -29.79 20.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.718 -178.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.471 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.55 -38.31 80.73 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 176.703 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.9 t -67.61 -35.04 78.21 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.459 -0.792 . . . . 0.0 109.347 176.584 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.797 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.7 mtm -64.42 -34.58 78.52 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.945 177.477 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.51 ' O ' ' HD3' ' A' ' 16' ' ' PRO . 1.2 mp -54.88 -44.83 74.41 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.367 179.036 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.3 -37.18 84.82 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.884 178.615 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.28 47.02 0.92 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.989 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.77 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -132.52 -41.55 0.03 OUTLIER Pre-proline 0 CA--C 1.537 0.461 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -177.829 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.735 ' HA ' ' O ' ' A' ' 17' ' ' PRO . 70.6 Cg_exo -46.35 153.59 1.08 Allowed 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 121.789 1.659 . . . . 0.0 112.814 -176.493 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.735 ' O ' ' HA ' ' A' ' 16' ' ' PRO . 59.8 Cg_endo -72.12 -101.91 0.0 OUTLIER 'Cis proline' 0 CA--C 1.539 0.751 0 C-N-CA 123.968 -1.263 . . . . 0.0 114.493 2.223 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -74.18 67.9 1.4 Allowed 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -175.74 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.77 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 1.4 tp10 -105.97 14.12 28.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.631 0.253 . . . . 0.0 110.838 176.83 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.614 ' NE2' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -46.88 -55.67 7.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.34 -178.386 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.722 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -56.26 -24.2 41.24 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.84 -178.571 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.558 ' H ' ' HD3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -72.54 -78.36 0.09 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.899 0.38 . . . . 0.0 111.862 -179.299 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.563 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.29 -95.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -176.37 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.563 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -60.39 -0.23 0.23 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -175.353 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 65.18 -115.69 8.02 Favored Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 108.431 -1.868 . . . . 0.0 108.431 -174.228 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.589 ' HG2' HG22 ' A' ' 50' ' ' ILE . 0.5 OUTLIER -75.52 -70.11 0.45 Allowed 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 168.64 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.699 ' HB2' HD13 ' A' ' 55' ' ' LEU . 12.7 tpt85 -160.37 10.53 0.1 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.152 -1.385 . . . . 0.0 107.67 174.499 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.995 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -58.88 -72.62 0.1 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 114.236 -1.347 . . . . 0.0 113.778 -173.025 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.675 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -35.81 -49.31 1.48 Allowed Pre-proline 0 CA--C 1.538 0.503 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -176.134 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.508 ' O ' ' HB3' ' A' ' 33' ' ' GLN . 53.0 Cg_exo -58.69 -42.39 54.19 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.436 2.091 . . . . 0.0 113.633 -178.708 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.944 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.09 -47.64 61.03 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.07 0.462 . . . . 0.0 109.998 -178.559 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.882 HG21 HD12 ' A' ' 43' ' ' ILE . 0.5 OUTLIER -75.07 -12.06 14.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.199 178.258 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.613 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 50.3 tp60 -62.39 -39.23 92.54 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 177.174 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.58 -30.23 67.95 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.011 174.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.582 ' HE1' ' HA ' ' A' ' 66' ' ' ARG . 6.7 mtt -100.55 28.25 5.22 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.333 178.116 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.613 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -64.96 -31.33 5.26 Favored Pre-proline 0 CA--C 1.536 0.433 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.324 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.593 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 55.7 Cg_exo -35.28 -33.03 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.265 0 C-N-CA 122.365 2.043 . . . . 0.0 112.535 179.549 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.402 ' N ' ' O ' ' A' ' 36' ' ' HIS . 67.8 m -78.18 -85.31 0.07 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.122 177.377 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.579 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.2 OUTLIER -171.19 50.85 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.547 179.014 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.484 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -37.02 -38.81 0.2 Allowed 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -179.536 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.675 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -44.23 -63.74 2.25 Favored Glycine 0 C--N 1.33 0.206 0 CA-C-N 115.998 -0.546 . . . . 0.0 114.208 -179.265 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.845 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.8 OUTLIER -77.48 -27.56 52.0 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.257 0.465 . . . . 0.0 112.257 -177.267 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.882 HD12 HG21 ' A' ' 32' ' ' ILE . 1.2 mt -54.01 -50.51 53.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.662 0.268 . . . . 0.0 111.195 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.995 ' HA ' HD22 ' A' ' 28' ' ' LEU . 10.6 t -55.4 -46.38 76.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.58 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.594 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -50.05 -59.38 7.58 Favored Glycine 0 N--CA 1.452 -0.253 0 CA-C-N 115.986 -0.552 . . . . 0.0 113.234 -179.732 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.522 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -56.89 -53.51 57.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.659 0.266 . . . . 0.0 111.371 -178.92 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.542 ' HB2' HD21 ' A' ' 28' ' ' LEU . 2.8 mm? -80.3 10.97 3.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.767 -178.836 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.594 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.48 -20.53 66.39 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.827 0.346 . . . . 0.0 110.613 179.711 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.449 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.2 mt-10 -76.0 21.54 0.17 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.793 179.222 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.589 HG22 ' HG2' ' A' ' 26' ' ' GLU . 0.2 OUTLIER -83.55 163.41 2.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.915 -179.669 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.493 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 1.3 m-20 -70.61 155.67 40.44 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.763 -178.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.873 ' HA ' HD23 ' A' ' 55' ' ' LEU . 17.4 m-80 -84.87 -29.94 24.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.861 177.418 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.502 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 18.3 m -74.09 -28.49 61.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.298 0.57 . . . . 0.0 109.677 177.021 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.537 ' O ' ' HG2' ' A' ' 58' ' ' MET . 0.2 OUTLIER -80.16 -28.28 38.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.402 178.839 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.873 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.8 OUTLIER -59.7 -47.52 85.33 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.684 -179.699 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.533 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 1.0 OUTLIER -64.31 -43.24 95.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.725 179.955 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 9.1 m-70 -58.8 -21.83 56.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.118 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.638 ' HB3' ' HG ' ' A' ' 65' ' ' LEU . 28.2 mmt -76.59 -49.54 16.07 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.472 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.58 HD22 ' HE ' ' A' ' 27' ' ' ARG . 2.6 pp -66.14 -10.63 42.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.673 0.273 . . . . 0.0 110.895 -179.703 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -106.8 -5.52 18.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.707 178.902 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.6 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 3.6 m -122.52 81.83 47.14 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.946 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -58.49 -33.74 98.23 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.239 1.959 . . . . 0.0 111.83 179.272 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -78.51 -48.84 14.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.82 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.6 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 15.5 m -70.98 -53.36 15.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.888 0.375 . . . . 0.0 111.533 -177.824 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.944 HD21 HD13 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -58.01 -61.39 2.58 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.434 -178.405 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.681 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.8 OUTLIER -49.69 -34.54 18.89 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.141 -177.679 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 15.1 m -68.37 -39.18 81.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.248 0.547 . . . . 0.0 110.149 178.13 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.615 ' HE2' ' SD ' ' A' ' 58' ' ' MET . 0.2 OUTLIER -65.99 -56.35 12.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.552 179.201 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.544 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 21.0 t -63.87 -20.74 27.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.345 178.805 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.641 ' O ' HG22 ' A' ' 73' ' ' VAL . 21.4 t70 -53.88 -48.68 69.83 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 176.885 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.491 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 1.6 tt0 -68.28 -29.47 68.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.937 176.835 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.586 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -58.35 -47.22 84.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.001 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.843 ' HA ' HD13 ' A' ' 43' ' ' ILE . 2.0 m -58.84 -31.72 45.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 177.56 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -69.03 -39.39 79.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.3 179.711 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.545 HG12 ' HB2' ' B' ' 5' ' ' ASN . 0.9 OUTLIER -55.73 -29.74 25.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-O 120.948 0.404 . . . . 0.0 109.917 179.487 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.845 HD11 ' HB3' ' A' ' 42' ' ' LYS . 3.5 mm? -71.84 -51.01 24.58 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.338 177.341 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.497 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 44.4 mm-40 -50.75 -34.76 28.46 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.223 -0.898 . . . . 0.0 110.004 179.236 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -82.0 -31.33 31.13 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.684 177.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.461 ' O ' ' HB3' ' A' ' 83' ' ' GLU . 1.6 t60 -60.13 -65.55 0.66 Allowed 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.055 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -67.51 -2.7 6.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.091 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.497 ' HB2' ' O ' ' A' ' 77' ' ' GLN . . . -79.6 -70.59 0.5 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.444 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.75 -22.05 59.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.555 -178.788 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.479 ' O ' ' HG2' ' A' ' 86' ' ' GLN . 0.2 OUTLIER -74.58 -44.85 48.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.076 -179.577 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -80.02 -47.61 14.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.206 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -84.0 38.3 0.64 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.394 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.762 ' HB2' ' HB ' ' A' ' 89' ' ' VAL . 2.2 pt20 -73.7 110.48 8.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.998 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.8 -67.42 0.85 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.883 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -74.61 -5.06 40.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.034 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.762 ' HB ' ' HB2' ' A' ' 86' ' ' GLN . 2.8 t -98.24 144.95 10.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.926 179.815 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -102.28 -174.66 2.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.954 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -96.3 85.93 4.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.918 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -89.8 24.28 2.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.109 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 1.4 p -111.6 21.69 15.85 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.899 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -86.86 -70.97 1.3 Allowed Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.514 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 3.4 t -107.51 130.31 23.01 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 120.61 0.243 . . . . 0.0 110.863 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -61.91 118.09 4.96 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.444 2.096 . . . . 0.0 112.287 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 21.7 p -95.5 32.21 1.84 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.893 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 6.6 m . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.091 -0.956 . . . . 0.0 111.009 179.948 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 7.5 t . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.82 0.343 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.1 p -92.22 138.27 20.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.969 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 2.4 ttmm -94.29 101.45 13.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.794 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.19 -171.56 3.16 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.015 -179.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 5' ' ' ASN . . . . . 0.545 ' HB2' HG12 ' A' ' 75' ' ' VAL . 9.7 m120 -115.6 -81.27 0.61 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.015 -179.837 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 14.2 mt -64.0 -76.51 0.07 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.765 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 7' ' ' ASN . . . . . 0.491 ' HA ' ' HD3' ' B' ' 8' ' ' PRO . 1.3 t-20 -76.62 126.57 85.87 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.669 179.066 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.491 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 4.6 Cg_exo -74.61 -4.46 15.45 Favored 'Trans proline' 0 N--CA 1.46 -0.476 0 C-N-CA 122.307 2.005 . . . . 0.0 112.037 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -123.65 54.8 1.28 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.022 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 10' ' ' ALA . . . . . 0.522 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.27 92.09 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.441 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.449 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 0.1 OUTLIER -109.47 165.76 11.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.628 179.137 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 12' ' ' GLU . . . . . 0.606 ' HG2' ' NZ ' ' A' ' 42' ' ' LYS . 1.8 tm-20 -67.85 165.07 18.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.65 179.374 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 13' ' ' PHE . . . . . 0.514 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.1 t80 -88.43 102.13 14.59 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.978 0.418 . . . . 0.0 110.635 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 45.5 t -109.49 92.88 12.59 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.033 178.405 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 15' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -55.68 -165.28 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 123.072 2.514 . . . . 0.0 113.063 -178.561 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 16' ' ' GLY . . . . . 0.432 ' C ' ' HE3' ' A' ' 21' ' ' LYS . . . 85.48 -52.12 4.58 Favored Glycine 0 N--CA 1.452 -0.261 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.323 -179.235 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 12.7 m -115.66 143.07 26.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.75 0.31 . . . . 0.0 111.013 179.174 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.722 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -61.66 97.12 0.07 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.725 179.849 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.29 125.67 25.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.932 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 85.5 34.63 13.43 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.417 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 21' ' ' ASN . . . . . 0.403 ' ND2' ' HG3' ' B' ' 18' ' ' LYS . 11.8 t30 -98.8 23.26 9.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.756 0.312 . . . . 0.0 111.023 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 12.2 pt . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.181 -0.914 . . . . 0.0 111.192 -179.843 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.189 0 CA-C-O 120.148 -0.251 . . . . 0.0 112.589 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -74.14 151.56 97.14 Favored 'Cis proline' 0 C--N 1.348 0.513 0 C-N-CA 123.318 -1.534 . . . . 0.0 112.439 0.337 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.448 ' H ' ' HG ' ' A' ' 3' ' ' LEU . 0.2 OUTLIER -98.64 74.69 2.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.887 179.84 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -100.37 123.76 8.03 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.535 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.408 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 36.2 t -81.89 139.65 46.6 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 120.574 0.226 . . . . 0.0 110.936 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 5' ' ' SER . 43.4 Cg_exo -56.81 -31.12 87.55 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.61 2.207 . . . . 0.0 112.229 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.487 ' O ' ' HG3' ' A' ' 11' ' ' MET . 1.0 OUTLIER -82.39 86.73 6.67 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.964 -179.744 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.76 HG21 ' HB3' ' A' ' 29' ' ' PHE . 10.5 t -88.01 -30.91 19.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.382 -179.816 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.36 -37.24 77.39 Favored 'General case' 0 N--CA 1.455 -0.225 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 177.201 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -70.72 -35.6 72.8 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.905 177.615 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.735 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 10.9 mtm -64.17 -36.85 85.42 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 177.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.66 HD11 ' HB3' ' A' ' 24' ' ' LEU . 1.4 mp -51.69 -52.43 48.31 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.975 179.047 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.45 -33.27 75.33 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.307 178.462 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.51 30.91 4.0 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.908 -178.118 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.451 ' HB1' ' CB ' ' A' ' 19' ' ' GLU . . . -147.24 120.21 4.85 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.044 179.18 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.471 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 19.6 Cg_endo -59.26 168.81 4.42 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.567 2.178 . . . . 0.0 111.82 179.1 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -58.05 -29.68 87.73 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.394 2.063 . . . . 0.0 112.158 179.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.46 -11.28 60.41 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.133 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.531 ' HA ' ' OE1' ' A' ' 19' ' ' GLU . 0.7 OUTLIER -88.5 12.2 15.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.792 -179.832 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.407 ' O ' HD12 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -46.73 -66.76 0.36 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.054 -0.521 . . . . 0.0 112.11 -177.568 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.733 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -56.74 -19.17 15.46 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -177.372 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.639 ' N ' ' HD2' ' A' ' 21' ' ' LYS . 1.8 tt0 -72.72 -78.05 0.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.911 0.386 . . . . 0.0 111.294 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.626 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.47 -97.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.419 -177.074 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.66 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -61.79 -1.04 0.54 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -175.836 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 65.1 -115.84 8.21 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 108.463 -1.855 . . . . 0.0 108.463 -174.079 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.42 ' O ' HD13 ' A' ' 24' ' ' LEU . 0.4 OUTLIER -76.06 -69.54 0.49 Allowed 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 169.447 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.837 ' HG3' HD21 ' A' ' 31' ' ' LEU . 6.3 tpt180 -159.63 12.21 0.13 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 114.309 -1.314 . . . . 0.0 108.107 176.622 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.593 HD12 HD11 ' A' ' 32' ' ' ILE . 3.8 mm? -57.76 -84.14 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.44 -1.255 . . . . 0.0 113.923 -173.412 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.76 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -32.66 -51.53 0.61 Allowed Pre-proline 0 CA--C 1.535 0.392 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -174.977 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.57 ' HG2' ' O ' ' A' ' 27' ' ' ARG . 10.0 Cg_endo -56.03 -41.98 71.32 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.479 2.119 . . . . 0.0 113.787 -177.615 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.837 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.61 -48.81 53.27 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 120.019 -0.672 . . . . 0.0 109.748 -179.427 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.837 HG21 HD12 ' A' ' 43' ' ' ILE . 0.7 OUTLIER -72.17 -13.51 16.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.304 178.578 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.647 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 5.8 tp60 -62.41 -40.01 95.15 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 177.312 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.71 -29.92 70.02 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.227 -0.897 . . . . 0.0 108.882 174.635 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.471 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 6.8 mtt -101.65 25.61 8.3 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.399 177.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.8 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 0.1 OUTLIER -64.07 -32.76 8.09 Favored Pre-proline 0 CA--C 1.536 0.429 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 -177.271 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.8 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 4.0 Cg_exo -36.21 -32.74 0.11 Allowed 'Trans proline' 0 C--N 1.364 1.343 0 C-N-CA 122.498 2.132 . . . . 0.0 112.099 179.33 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' THR . . . . . 1.006 HG21 HG13 ' A' ' 73' ' ' VAL . 0.2 OUTLIER -78.23 -87.23 0.06 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.898 176.83 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.533 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.3 OUTLIER -171.29 59.97 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.371 178.388 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.503 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -48.64 -31.36 6.6 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 120.894 0.378 . . . . 0.0 111.309 179.475 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.647 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -44.43 -63.99 2.21 Favored Glycine 0 N--CA 1.453 -0.225 0 CA-C-N 115.684 -0.689 . . . . 0.0 114.372 -178.505 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.563 ' HE3' ' HG3' ' B' ' 12' ' ' GLU . 0.0 OUTLIER -77.79 -29.61 50.93 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -176.999 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.918 HD11 HD11 ' A' ' 76' ' ' LEU . 15.9 mt -53.88 -53.92 23.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.467 -178.622 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.555 HG21 ' CD2' ' A' ' 29' ' ' PHE . 6.7 t -47.14 -46.6 23.36 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.143 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.64 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -53.44 -61.06 7.37 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.917 -0.583 . . . . 0.0 113.022 179.304 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.575 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.45 -52.6 63.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.665 0.269 . . . . 0.0 111.492 -178.516 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.582 HD11 ' HB3' ' B' ' 6' ' ' LEU . 3.0 mm? -80.04 5.72 13.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.685 -178.327 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.474 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.0 -16.58 64.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.837 0.351 . . . . 0.0 110.717 179.57 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' B' ' 9' ' ' ASN . 3.4 mm-40 -76.65 18.84 0.3 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.807 179.513 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.43 ' H ' ' C ' ' A' ' 48' ' ' LEU . 0.4 OUTLIER -83.23 161.3 3.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.528 179.89 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.55 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 6.3 m-20 -70.49 155.51 40.61 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.98 0.419 . . . . 0.0 111.51 -178.394 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.887 ' HA ' HD23 ' A' ' 55' ' ' LEU . 5.1 m120 -83.33 -30.95 27.08 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.323 178.544 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.2 t -74.04 -33.7 63.82 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.302 0.572 . . . . 0.0 109.521 177.678 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.55 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -77.96 -24.93 47.95 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.552 179.445 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.887 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -60.28 -48.11 83.15 Favored 'General case' 0 C--O 1.231 0.121 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 178.461 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.431 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 2.0 tm? -58.71 -39.88 82.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.094 178.679 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.49 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 12.9 t-80 -60.19 -40.21 89.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.543 178.707 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.563 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -62.21 -41.65 98.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.073 0.463 . . . . 0.0 110.309 178.815 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.649 HD12 ' CZ ' ' A' ' 27' ' ' ARG . 8.1 tt -67.19 -19.51 65.58 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.7 178.939 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 57' ' ' HIS . 5.2 pt-20 -105.03 -6.6 19.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.52 -178.935 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.564 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.3 OUTLIER -123.0 86.79 50.94 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.139 -179.69 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.467 ' O ' ' HB2' ' A' ' 66' ' ' ARG . 23.9 Cg_endo -61.3 -30.13 87.3 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.18 1.92 . . . . 0.0 111.863 179.038 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -78.09 -51.13 10.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.436 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.415 ' O ' ' HB2' ' A' ' 67' ' ' SER . 66.9 m -69.83 -50.43 42.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.633 -178.307 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.827 HD21 HD13 ' A' ' 31' ' ' LEU . 0.0 OUTLIER -58.03 -59.77 4.75 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.282 -178.626 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.63 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -51.78 -30.27 22.31 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.618 -178.635 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.57 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 2.5 m -67.36 -37.71 83.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.314 178.356 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.459 ' HE3' ' OE2' ' A' ' 54' ' ' GLU . 3.2 mtmm -65.72 -59.33 4.02 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.164 178.516 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.567 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 74.9 t -62.75 -18.71 21.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.58 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.57 ' HB3' ' O ' ' A' ' 67' ' ' SER . 7.3 t70 -56.92 -48.82 77.35 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 176.2 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.41 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 43.8 tt0 -67.87 -29.31 68.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.628 176.24 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.805 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -59.27 -42.74 91.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.341 178.45 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 1.006 HG13 HG21 ' A' ' 38' ' ' THR . 14.6 t -60.73 -30.52 47.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 176.846 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -73.52 -31.88 63.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.056 178.694 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.73 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.1 m -61.0 -30.02 46.81 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.084 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 179.234 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.918 HD11 HD11 ' A' ' 43' ' ' ILE . 76.2 mt -65.94 -56.67 10.54 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 121.233 0.54 . . . . 0.0 109.942 177.227 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 21.2 mm100 -51.02 -36.11 37.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.026 -0.988 . . . . 0.0 110.591 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.81 -27.54 33.6 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.042 178.194 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.595 ' HB2' ' O ' ' A' ' 75' ' ' VAL . 0.9 OUTLIER -74.96 -23.0 58.22 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.196 -179.337 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -73.31 5.84 3.32 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.209 -179.474 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -80.51 -77.41 0.2 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.532 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -80.22 -24.78 39.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.758 -178.288 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.563 ' HB3' ' O ' ' A' ' 79' ' ' HIS . 37.3 tp10 -74.35 -31.9 62.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.585 -0.28 . . . . 0.0 111.245 -178.897 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -69.69 -4.11 18.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.373 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -69.84 -16.77 63.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.083 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 13.5 mt-30 -77.0 -67.02 0.75 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.928 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.39 88.26 3.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.818 179.705 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -82.5 -4.54 57.69 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.227 -179.625 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.5 p -79.68 96.18 2.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.039 0.447 . . . . 0.0 110.852 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -104.4 116.55 32.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.989 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.52 60.64 5.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.711 179.599 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.46 104.27 0.49 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.176 -179.699 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 8.2 t -98.29 -24.72 15.12 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.878 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -93.41 -118.03 2.71 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.539 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -106.89 135.95 19.5 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.678 0.275 . . . . 0.0 110.866 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.43 -155.95 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.559 2.173 . . . . 0.0 112.327 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.52 -68.73 0.59 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.905 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.084 -0.96 . . . . 0.0 110.998 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.815 0.341 . . . . 0.0 110.953 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 22.4 t -89.83 91.88 3.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.985 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.96 136.89 35.24 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.081 -179.602 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -93.29 -165.69 1.38 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.918 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 -106.86 -80.66 0.56 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.832 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.582 ' HB3' HD11 ' A' ' 47' ' ' LEU . 9.7 tp -62.82 -81.36 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.769 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 7' ' ' ASN . . . . . 0.446 ' HB2' ' CD1' ' A' ' 47' ' ' LEU . 1.7 t-20 -78.75 130.03 71.92 Favored Pre-proline 0 C--N 1.332 -0.194 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.706 178.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.93 1.38 8.95 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.107 1.871 . . . . 0.0 112.108 179.369 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 9' ' ' ASN . . . . . 0.477 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 13.3 m120 -123.52 46.71 2.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.918 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 10' ' ' ALA . . . . . 0.575 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.27 95.82 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.573 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.425 ' HG3' ' O ' ' B' ' 9' ' ' ASN . 1.0 OUTLIER -121.49 170.46 9.64 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.502 178.949 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 12' ' ' GLU . . . . . 0.563 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 2.3 tt0 -68.06 163.8 21.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.795 0.331 . . . . 0.0 111.03 179.738 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 13' ' ' PHE . . . . . 0.64 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.2 t80 -92.32 112.52 24.49 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.152 -179.545 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -112.63 91.24 16.68 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.539 178.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 15' ' ' PRO . . . . . 0.546 ' HB3' ' HA ' ' A' ' 22' ' ' GLN . 50.6 Cg_exo -55.22 -175.55 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.695 2.264 . . . . 0.0 112.998 -178.747 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 16' ' ' GLY . . . . . 0.418 ' C ' ' HD3' ' A' ' 21' ' ' LYS . . . 85.28 -49.42 4.2 Favored Glycine 0 N--CA 1.452 -0.278 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.678 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 2.6 m -115.61 141.51 32.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.87 0.367 . . . . 0.0 111.246 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.733 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -62.32 100.98 0.2 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.954 -179.889 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -75.85 119.91 20.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.004 -179.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.14 86.06 0.22 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.43 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -88.63 -90.72 0.13 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.839 0.352 . . . . 0.0 111.016 -179.696 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.328 -0.844 . . . . 0.0 111.058 -179.613 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.296 0 N-CA-C 112.414 -0.274 . . . . 0.0 112.414 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -59.75 -24.51 76.0 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.556 2.17 . . . . 0.0 112.142 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.74 102.87 2.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.86 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.415 ' O ' ' HD3' ' A' ' 6' ' ' PRO . . . -88.02 95.62 2.1 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.563 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -87.02 110.61 34.4 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-O 120.518 0.199 . . . . 0.0 111.02 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.453 ' HB2' ' HB2' ' A' ' 10' ' ' SER . 44.5 Cg_exo -57.19 118.52 5.4 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.649 2.232 . . . . 0.0 112.25 -179.806 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.417 ' O ' ' HG3' ' A' ' 11' ' ' MET . 1.1 mt -96.85 -69.6 0.75 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.968 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.796 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 10.8 t -87.99 -28.1 21.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.521 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.517 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.46 -38.26 80.31 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 176.857 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.453 ' HB2' ' HB2' ' A' ' 6' ' ' PRO . 10.7 t -71.13 -34.35 70.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.608 177.184 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.796 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 5.3 mtm -64.36 -33.92 76.96 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 177.139 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.759 HD12 ' SD ' ' A' ' 23' ' ' MET . 3.7 mp -52.79 -54.66 30.89 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.891 178.421 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.32 -25.92 67.06 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.242 178.8 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.1 m -101.66 14.02 33.2 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.963 -178.158 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.632 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -134.76 118.05 13.22 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 120.515 0.198 . . . . 0.0 111.281 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.443 ' HD2' ' OE1' ' A' ' 19' ' ' GLU . 47.3 Cg_exo -56.36 167.34 2.72 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.628 2.218 . . . . 0.0 112.008 179.39 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -54.29 -37.47 88.47 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.395 2.064 . . . . 0.0 112.366 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -72.21 -18.63 61.83 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.929 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.632 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.9 OUTLIER -85.1 16.01 3.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.92 179.885 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.486 ' O ' HD12 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -60.87 -49.44 77.48 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.354 179.626 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.566 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -56.88 -21.74 31.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.255 -179.82 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.566 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 12.5 tp60 -73.84 -80.49 0.07 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.035 0.445 . . . . 0.0 111.641 179.562 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.759 ' SD ' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -70.05 -94.87 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -176.032 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.605 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -58.91 0.96 0.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -174.993 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.411 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . 64.83 -117.13 9.87 Favored Glycine 0 N--CA 1.444 -0.791 0 N-CA-C 108.342 -1.903 . . . . 0.0 108.342 -174.488 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' A' ' 51' ' ' ASP . 2.2 mp0 -76.06 -69.12 0.52 Allowed 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 169.083 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.846 ' HB2' HD13 ' A' ' 55' ' ' LEU . 1.7 tpt180 -159.99 9.27 0.1 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.259 -1.337 . . . . 0.0 107.939 175.065 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.969 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.59 -69.78 0.19 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 114.308 -1.315 . . . . 0.0 113.561 -173.61 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.588 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -37.93 -49.0 3.02 Favored Pre-proline 0 CA--C 1.538 0.503 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -175.847 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.599 ' HG2' ' HD2' ' A' ' 27' ' ' ARG . 46.5 Cg_exo -58.97 -43.89 39.52 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 122.37 2.046 . . . . 0.0 113.505 -178.677 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.609 HD13 ' CD1' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.89 -46.02 63.32 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.216 -178.313 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.852 HD11 HD23 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -74.96 -12.61 15.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.166 178.087 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.636 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -62.09 -39.77 93.57 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 176.557 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.46 -31.77 72.16 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.058 174.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.518 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 6.4 mtt -100.23 27.42 5.66 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.394 178.185 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.636 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 2.0 p-80 -65.31 -31.99 5.8 Favored Pre-proline 0 CA--C 1.536 0.431 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 -177.383 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.581 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 47.5 Cg_exo -35.78 -32.53 0.1 OUTLIER 'Trans proline' 0 C--N 1.361 1.209 0 C-N-CA 122.278 1.985 . . . . 0.0 112.597 179.709 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.405 ' HB ' ' H ' ' A' ' 39' ' ' LEU . 16.9 m -78.28 -83.27 0.09 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.131 177.144 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.516 HD12 ' HB2' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -171.09 52.77 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.201 178.828 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.485 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -38.33 -42.54 0.72 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.97 -179.408 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.588 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -52.73 -49.44 53.62 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 121.046 -0.597 . . . . 0.0 113.641 -178.706 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.953 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.1 OUTLIER -77.05 -36.7 55.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 117.061 0.431 . . . . 0.0 111.616 -178.491 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.72 HD12 HG21 ' A' ' 32' ' ' ILE . 0.4 OUTLIER -53.63 -62.62 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.724 0.297 . . . . 0.0 110.721 -179.846 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.969 ' HA ' HD22 ' A' ' 28' ' ' LEU . 8.9 t -48.56 -44.11 36.26 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.261 178.622 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.881 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -48.12 -67.79 1.47 Allowed Glycine 0 C--O 1.227 -0.289 0 CA-C-N 115.655 -0.702 . . . . 0.0 113.201 179.851 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.501 ' HA ' ' C ' ' B' ' 11' ' ' LYS . 0.0 OUTLIER -54.68 -56.83 14.97 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.797 0.295 . . . . 0.0 111.797 -178.057 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.861 HD23 ' HB2' ' B' ' 7' ' ' ASN . 2.8 mp -79.99 17.42 0.98 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 -177.683 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.639 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.72 -18.09 65.19 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.121 0.486 . . . . 0.0 109.871 177.044 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.601 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.1 mt-10 -74.65 19.96 0.13 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.335 179.513 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.435 ' H ' ' C ' ' A' ' 48' ' ' LEU . 1.8 tt -83.29 162.74 3.11 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-O 120.828 0.347 . . . . 0.0 110.959 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.487 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 1.1 m-20 -71.18 154.73 41.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.102 -0.499 . . . . 0.0 112.288 -178.298 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.766 ' HA ' HD23 ' A' ' 55' ' ' LEU . 3.7 m-80 -82.54 -27.39 31.68 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.551 176.192 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -74.19 -32.91 63.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.805 177.585 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.4 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 4.5 mt-10 -75.71 -28.7 58.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.419 178.842 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.846 HD13 ' HB2' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -59.84 -46.94 87.7 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.149 179.288 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.406 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -57.57 -48.6 78.89 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.505 179.255 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.405 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 0.3 OUTLIER -57.26 -40.12 77.01 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.865 179.776 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.565 ' SD ' ' HE2' ' A' ' 68' ' ' LYS . 12.9 mmt -64.41 -41.55 96.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.01 0.434 . . . . 0.0 110.294 179.104 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.454 HD12 ' NE ' ' A' ' 27' ' ' ARG . 4.9 tt -69.39 -14.99 63.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.78 179.712 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.405 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 0.0 OUTLIER -106.58 -9.12 16.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.35 -179.751 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.649 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -123.22 85.65 51.59 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.934 -179.678 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_endo -61.34 -33.1 89.76 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.295 1.997 . . . . 0.0 112.173 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.32 -46.36 20.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.463 -179.429 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 30.8 m -70.22 -48.39 57.26 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.859 0.361 . . . . 0.0 111.316 -178.629 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.65 ' HG ' ' N ' ' A' ' 66' ' ' ARG . 0.1 OUTLIER -58.01 -58.57 7.82 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.749 -178.937 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.65 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -50.9 -34.07 26.87 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.241 -177.625 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.54 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 35.3 t -63.41 -41.95 98.75 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.118 0.485 . . . . 0.0 110.153 178.246 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.565 ' HE2' ' SD ' ' A' ' 58' ' ' MET . 1.0 OUTLIER -66.21 -57.32 7.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.686 179.285 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.553 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 71.1 t -63.36 -19.08 23.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.775 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.638 ' O ' HG22 ' A' ' 73' ' ' VAL . 7.5 t70 -56.97 -48.85 77.42 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 176.539 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.518 ' HB3' HD12 ' B' ' 6' ' ' LEU . 0.8 OUTLIER -68.87 -25.54 64.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.843 176.56 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.688 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -61.18 -48.78 79.99 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.845 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.658 ' HA ' HD13 ' A' ' 43' ' ' ILE . 2.6 m -58.68 -30.14 41.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 177.334 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.51 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -69.08 -37.98 78.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.287 -0.869 . . . . 0.0 111.196 179.331 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.549 HG22 ' O ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -57.31 -29.02 31.8 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 178.664 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.953 HD11 ' HB3' ' A' ' 42' ' ' LYS . 3.9 mm? -72.0 -50.7 26.47 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.073 177.081 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 67.6 mm-40 -51.38 -31.25 21.73 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.241 -0.891 . . . . 0.0 109.697 178.294 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.47 -30.09 33.51 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.581 177.565 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 2.7 t-160 -59.28 -20.26 52.93 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.636 179.332 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.861 ' HA ' ' HG2' ' A' ' 83' ' ' GLU . 5.4 mt-30 -72.79 6.07 2.78 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.415 -179.494 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.65 -70.05 0.54 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.201 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 8.0 mptt -80.32 -21.55 42.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.597 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.861 ' HG2' ' HA ' ' A' ' 80' ' ' GLN . 0.7 OUTLIER -74.35 -35.7 63.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.888 0.375 . . . . 0.0 111.387 -178.758 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -72.36 6.97 1.98 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.568 -179.512 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.89 -32.61 74.19 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.988 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -79.85 173.44 12.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.004 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.52 -1.72 56.74 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.977 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -89.41 26.88 1.57 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.092 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 5.4 p -96.44 7.77 7.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.904 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -89.89 50.19 1.84 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.062 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -83.09 172.68 12.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.798 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -79.01 89.73 4.78 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.941 179.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 72.2 p -117.6 110.88 18.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.005 -179.711 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -90.21 2.72 81.66 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.401 179.6 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 8.8 t -90.25 133.02 34.1 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-O 120.344 0.116 . . . . 0.0 110.954 -179.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.466 ' HG2' ' H ' ' A' ' 97' ' ' THR . 73.5 Cg_endo -78.09 -63.48 0.03 OUTLIER 'Cis proline' 0 C--N 1.349 0.565 0 C-N-CA 123.557 -1.434 . . . . 0.0 112.758 0.778 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.466 ' H ' ' HG2' ' A' ' 96' ' ' PRO . 4.8 t -107.98 -21.86 12.65 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.046 -179.585 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.6 m . . . . . 0 C--O 1.249 1.064 0 CA-C-O 117.965 -1.017 . . . . 0.0 111.111 -179.882 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.418 0 CA-C-O 120.604 0.24 . . . . 0.0 110.758 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 21.0 m -79.28 149.36 5.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.078 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.76 117.43 27.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.964 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 2.0 m -86.69 -175.54 5.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.687 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -103.98 -43.32 5.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.997 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.518 HD12 ' HB3' ' A' ' 71' ' ' GLU . 0.8 OUTLIER -80.62 -81.43 0.13 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.84 -179.982 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 7' ' ' ASN . . . . . 0.861 ' HB2' HD23 ' A' ' 47' ' ' LEU . 0.8 OUTLIER -81.47 122.82 81.22 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.757 179.452 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -78.54 9.88 3.02 Favored 'Trans proline' 0 N--CA 1.459 -0.517 0 C-N-CA 122.16 1.906 . . . . 0.0 112.034 179.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 9' ' ' ASN . . . . . 0.519 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 56.5 m-20 -123.25 34.33 5.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.034 -179.784 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.77 90.01 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.654 -179.57 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.601 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 1.9 mttm -129.1 138.56 51.91 Favored 'General case' 0 C--O 1.226 -0.179 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.132 178.625 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -46.58 163.04 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -177.187 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 13' ' ' PHE . . . . . 0.881 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.7 OUTLIER -87.28 82.28 7.66 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.786 179.433 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 14' ' ' VAL . . . . . 0.581 ' H ' ' CD ' ' B' ' 15' ' ' PRO . 1.7 m -118.15 -43.0 0.05 OUTLIER Pre-proline 0 CA--C 1.539 0.542 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -176.532 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 15' ' ' PRO . . . . . 0.581 ' CD ' ' H ' ' B' ' 14' ' ' VAL . 86.2 Cg_exo -45.64 -39.67 18.05 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 122.262 1.975 . . . . 0.0 112.894 -178.59 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 77.78 -22.63 2.76 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.219 -179.2 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.717 HG22 ' H ' ' B' ' 18' ' ' LYS . 1.8 p -94.97 -176.37 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 110.373 -0.232 . . . . 0.0 110.373 179.27 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.717 ' H ' HG22 ' B' ' 17' ' ' VAL . 5.0 mttm -59.86 94.01 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.906 0.384 . . . . 0.0 110.825 -179.858 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.466 ' HD1' ' HA ' ' B' ' 19' ' ' TYR . 0.1 OUTLIER -84.75 117.97 24.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.83 -179.679 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 79.33 47.56 7.37 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.823 -0.704 . . . . 0.0 112.529 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 28.3 t30 -95.27 -0.02 53.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.811 0.339 . . . . 0.0 110.883 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 22' ' ' ILE . . . . . 0.447 HD13 ' N ' ' B' ' 22' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.174 -0.917 . . . . 0.0 111.019 179.849 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.113 0 N-CA-C 112.496 -0.242 . . . . 0.0 112.496 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -74.5 -20.25 18.31 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.508 2.139 . . . . 0.0 112.425 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.43 179.41 7.81 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.048 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -91.28 -68.69 1.17 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.567 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.25 133.71 31.13 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-O 120.598 0.237 . . . . 0.0 110.906 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.13 -166.81 0.21 Allowed 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.441 2.094 . . . . 0.0 112.223 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.439 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.3 OUTLIER -81.1 122.92 27.94 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.964 -179.985 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.794 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 8.2 t -87.87 -28.85 21.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.372 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.452 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.43 -39.24 82.87 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 176.418 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 39.3 t -68.94 -33.1 73.17 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.454 176.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.794 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.2 mtm -64.13 -34.86 79.01 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.818 177.776 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.502 HD11 ' HB3' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -55.25 -49.96 70.69 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.329 178.684 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.05 -32.41 73.86 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.611 178.629 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.1 m -101.38 46.67 0.93 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.76 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.845 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -131.97 -39.84 0.03 OUTLIER Pre-proline 0 CA--C 1.537 0.447 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 -178.027 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.74 ' HD2' ' H ' ' A' ' 15' ' ' ALA . 92.2 Cg_exo -46.85 141.26 12.0 Favored 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 121.674 1.583 . . . . 0.0 112.038 -178.448 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.71 ' O ' ' HA ' ' A' ' 16' ' ' PRO . 16.7 Cg_exo -71.12 -140.49 0.16 OUTLIER 'Cis proline' 0 C--N 1.354 0.826 0 C-N-CA 124.498 -1.043 . . . . 0.0 114.209 3.902 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -52.85 77.64 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 -176.616 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.845 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 2.1 tp10 -106.59 13.83 27.77 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.879 175.957 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.464 ' HA ' HD11 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -46.25 -56.31 5.95 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.672 -177.512 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.519 ' HG3' ' H ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -56.02 -24.3 38.37 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.506 -178.342 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.475 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 17.1 tp60 -73.6 -78.45 0.09 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.908 0.385 . . . . 0.0 111.838 179.398 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.587 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -68.96 -97.29 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 112.997 0.74 . . . . 0.0 112.997 -175.93 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.587 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -57.03 0.34 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.275 0 N-CA-C 113.51 0.929 . . . . 0.0 113.51 -175.519 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.419 ' H ' ' C ' ' A' ' 23' ' ' MET . . . 64.79 -117.19 9.99 Favored Glycine 0 CA--C 1.505 -0.594 0 N-CA-C 108.269 -1.932 . . . . 0.0 108.269 -174.685 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.535 ' HG2' HG22 ' A' ' 50' ' ' ILE . 0.4 OUTLIER -75.56 -68.27 0.58 Allowed 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 168.089 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.832 ' HE ' HD13 ' A' ' 59' ' ' LEU . 1.1 tpt180 -160.52 8.42 0.09 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.151 -1.386 . . . . 0.0 107.999 174.37 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.955 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.23 -73.96 0.08 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.551 -1.204 . . . . 0.0 113.896 -172.921 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.578 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.2 OUTLIER -36.79 -49.79 1.99 Allowed Pre-proline 0 CA--C 1.536 0.431 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -175.336 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.602 ' HG2' ' O ' ' A' ' 27' ' ' ARG . 12.4 Cg_endo -58.95 -41.69 59.41 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 121.975 1.783 . . . . 0.0 113.128 -178.053 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.637 HD13 ' CD1' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -71.06 -45.44 63.79 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 120.339 -0.545 . . . . 0.0 110.182 -179.663 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.642 HD11 HD23 ' A' ' 28' ' ' LEU . 0.8 OUTLIER -71.56 -17.27 19.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.313 -0.403 . . . . 0.0 109.933 177.59 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.643 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 2.0 tt0 -63.26 -32.51 73.93 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 176.455 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.5 -29.64 65.04 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.679 -0.859 . . . . 0.0 108.679 175.02 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.427 ' HE1' ' HB ' ' A' ' 69' ' ' VAL . 8.9 mtt -100.08 19.67 15.91 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 114.84 -1.073 . . . . 0.0 109.72 177.242 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.643 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.6 OUTLIER -63.81 -34.8 13.25 Favored Pre-proline 0 CA--C 1.532 0.263 0 CA-C-N 115.511 -0.768 . . . . 0.0 112.106 -178.636 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.542 ' CD ' ' N ' ' A' ' 36' ' ' HIS . 87.4 Cg_exo -42.18 -26.22 0.5 Allowed 'Trans proline' 0 C--N 1.361 1.191 0 C-N-CA 121.769 1.646 . . . . 0.0 111.066 177.323 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' THR . . . . . 1.081 HG21 HG13 ' A' ' 73' ' ' VAL . 86.8 m -77.99 -80.95 0.1 Allowed 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.325 -0.852 . . . . 0.0 109.556 176.089 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.612 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -171.63 52.51 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 112.608 0.595 . . . . 0.0 112.608 178.61 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -56.86 149.51 18.33 Favored 'General case' 0 C--O 1.231 0.127 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 176.681 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.578 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . 132.57 -73.41 0.46 Allowed Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.566 -178.364 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.56 -28.17 51.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.698 0.285 . . . . 0.0 111.043 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.627 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 55.2 mt -54.05 -53.77 25.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.795 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.955 ' HA ' HD22 ' A' ' 28' ' ' LEU . 13.1 t -54.25 -37.02 64.21 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.827 0.346 . . . . 0.0 110.538 178.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.857 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -48.12 -70.5 0.73 Allowed Glycine 0 N--CA 1.45 -0.418 0 CA-C-N 115.745 -0.661 . . . . 0.0 113.119 -179.573 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.473 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.36 -45.67 76.48 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -178.127 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.47 HD11 ' HB3' ' B' ' 6' ' ' LEU . 3.1 mm? -79.91 7.7 8.36 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -177.805 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.616 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.34 -7.38 18.6 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.881 0.372 . . . . 0.0 110.853 179.556 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.41 ' OE1' ' HG3' ' B' ' 11' ' ' LYS . 1.2 mm-40 -85.65 18.55 2.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.807 179.187 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.535 HG22 ' HG2' ' A' ' 26' ' ' GLU . 0.8 OUTLIER -83.72 162.63 3.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.861 -179.684 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.51 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 21.3 m-20 -70.96 157.58 37.95 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.902 0.382 . . . . 0.0 111.778 -178.506 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.928 ' HA ' HD23 ' A' ' 55' ' ' LEU . 7.7 m-80 -87.07 -29.87 21.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.91 -0.587 . . . . 0.0 109.971 177.72 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.1 -30.51 62.37 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 177.094 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.51 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -78.38 -27.41 46.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.59 179.058 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.928 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.8 OUTLIER -61.6 -47.07 87.14 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.473 179.98 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 58.1 tp -61.9 -43.85 98.01 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.946 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -60.2 -28.48 68.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.443 -179.644 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.55 ' HB3' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -68.39 -51.07 48.13 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.529 -179.076 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.832 HD13 ' HE ' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -63.58 -20.24 65.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.194 -179.303 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -95.53 -5.84 41.84 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.02 0.438 . . . . 0.0 110.496 178.712 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.631 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 5.1 m -122.69 79.46 48.27 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.631 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -55.29 -34.57 88.95 Favored 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 122.36 2.04 . . . . 0.0 112.178 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -78.41 -49.34 13.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.945 -179.36 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.534 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 15.7 m -69.2 -45.96 68.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.961 0.41 . . . . 0.0 111.39 -178.029 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.637 ' CD1' HD13 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -59.46 -61.49 2.59 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.774 -178.558 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.627 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -50.78 -31.76 17.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.208 -177.538 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.531 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 20.7 t -63.86 -42.76 97.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.11 0.481 . . . . 0.0 110.276 178.346 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.404 ' HG2' HD21 ' B' ' 6' ' ' LEU . 6.3 ttmm -66.31 -58.12 6.01 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.853 179.472 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.478 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 79.3 t -62.37 -20.78 25.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.616 179.664 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.531 ' HB3' ' O ' ' A' ' 67' ' ' SER . 9.6 t0 -54.71 -49.08 71.59 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 176.343 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.507 ' HG2' ' HB3' ' B' ' 5' ' ' ASN . 0.5 OUTLIER -68.88 -29.48 67.79 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.847 176.495 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.627 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -60.44 -38.01 82.74 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.087 178.068 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 1.081 HG13 HG21 ' A' ' 38' ' ' THR . 3.6 t -64.74 -29.35 47.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 176.781 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.446 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -73.15 -38.94 66.06 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.251 179.375 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.568 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.07 -30.34 38.79 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-O 121.127 0.489 . . . . 0.0 110.086 179.343 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.612 ' HG ' ' HB3' ' A' ' 39' ' ' LEU . 3.0 tm? -71.19 -52.78 17.18 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.209 178.689 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -55.99 -34.52 65.85 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.614 179.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.01 -23.04 38.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.787 179.045 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.6 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 19.3 t60 -70.23 -49.21 52.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.86 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -71.48 -5.25 31.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.18 -179.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -64.06 -66.89 0.48 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.962 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.4 -15.69 57.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.83 179.711 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.6 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 1.8 tm-20 -76.82 -26.04 53.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.029 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -68.24 -16.75 64.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.126 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.35 -31.52 72.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.044 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -93.25 -30.7 15.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.942 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.4 ttmt -83.67 114.83 21.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.972 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -80.43 83.82 6.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.986 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -85.19 155.88 3.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.035 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -74.48 176.67 6.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.91 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.2 5.15 23.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.052 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -90.0 84.5 6.18 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.11 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 16.5 p -104.69 119.31 38.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.901 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -103.04 49.29 0.97 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.511 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.53 ' N ' ' HD2' ' A' ' 96' ' ' PRO . 11.4 t -81.37 -51.21 0.89 Allowed Pre-proline 0 C--N 1.329 -0.312 0 N-CA-C 111.553 0.205 . . . . 0.0 111.553 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.53 ' HD2' ' N ' ' A' ' 95' ' ' VAL . 39.3 Cg_endo -66.78 134.37 34.68 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 122.19 1.927 . . . . 0.0 112.238 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 32.4 p -89.14 40.18 0.97 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.01 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.053 -0.975 . . . . 0.0 111.047 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 3.4 t . . . . . 0 N--CA 1.486 1.325 0 CA-C-O 120.764 0.316 . . . . 0.0 110.921 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 2' ' ' VAL . . . . . 0.623 HG11 ' HB3' ' B' ' 10' ' ' ALA . 12.2 t -81.72 139.73 17.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.076 -179.707 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 5.8 mtpt -95.16 66.56 2.95 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.895 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 4' ' ' SER . . . . . 0.502 ' HB3' ' O ' ' B' ' 7' ' ' ASN . 8.4 t -89.67 -174.98 4.51 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.846 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 5' ' ' ASN . . . . . 0.507 ' HB3' ' HG2' ' A' ' 71' ' ' GLU . 2.8 m120 -104.15 -57.35 2.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.923 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.47 ' HB3' HD11 ' A' ' 47' ' ' LEU . 0.2 OUTLIER -71.27 -84.52 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.685 179.806 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 7' ' ' ASN . . . . . 0.502 ' O ' ' HB3' ' B' ' 4' ' ' SER . 1.3 t-20 -78.41 139.11 59.38 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.851 179.688 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -79.01 -9.21 15.5 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 122.328 2.018 . . . . 0.0 111.94 178.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 72.7 m-80 -123.31 57.79 1.14 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.79 179.79 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 10' ' ' ALA . . . . . 0.623 ' HB3' HG11 ' B' ' 2' ' ' VAL . . . -59.76 93.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.603 -179.613 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.41 ' HG3' ' OE1' ' A' ' 49' ' ' GLU . 10.2 mttp -114.02 125.19 53.71 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.337 179.038 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -48.74 168.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -177.797 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 13' ' ' PHE . . . . . 0.857 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.5 OUTLIER -87.78 80.25 7.93 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.07 179.159 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 14' ' ' VAL . . . . . 0.531 ' H ' ' CD ' ' B' ' 15' ' ' PRO . 1.3 m -116.34 -45.07 0.05 OUTLIER Pre-proline 0 CA--C 1.539 0.53 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -176.882 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 15' ' ' PRO . . . . . 0.531 ' CD ' ' H ' ' B' ' 14' ' ' VAL . 80.9 Cg_exo -47.6 -40.02 30.05 Favored 'Trans proline' 0 C--N 1.354 0.854 0 C-N-CA 122.218 1.945 . . . . 0.0 112.872 -178.508 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 16' ' ' GLY . . . . . 0.425 ' O ' ' HD2' ' A' ' 21' ' ' LYS . . . 82.85 -26.95 4.0 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.339 -179.658 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 29.2 m -95.13 -172.06 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.516 0.198 . . . . 0.0 110.682 179.425 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.31 90.67 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.939 0.4 . . . . 0.0 110.674 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.425 ' CD1' ' HG2' ' B' ' 15' ' ' PRO . 0.3 OUTLIER -78.37 124.7 28.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.008 -179.427 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 93.72 40.6 4.64 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.408 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 33.5 t30 -97.22 -15.45 20.84 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.813 0.339 . . . . 0.0 110.998 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 29.7 mm . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.213 -0.899 . . . . 0.0 111.021 -179.972 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.411 ' HA2' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.489 2.231 0 CA-C-O 120.123 -0.265 . . . . 0.0 112.524 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.851 ' HB3' ' HG ' ' A' ' 7' ' ' LEU . 21.6 Cg_exo -65.64 80.61 0.25 Allowed 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.756 2.304 . . . . 0.0 112.268 -179.824 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -100.02 -67.18 0.86 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.926 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -107.3 -97.55 2.52 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.55 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.531 ' HB3' ' HD3' ' A' ' 6' ' ' PRO . 2.1 t -82.37 -50.73 0.79 Allowed Pre-proline 0 CA--C 1.533 0.322 0 N-CA-C 111.428 0.159 . . . . 0.0 111.428 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.531 ' HD3' ' HB3' ' A' ' 5' ' ' SER . 26.4 Cg_exo -63.45 86.13 0.13 Allowed 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.296 1.997 . . . . 0.0 112.296 -179.62 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.851 ' HG ' ' HB3' ' A' ' 2' ' ' PRO . 0.1 OUTLIER -100.85 -73.47 0.64 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.883 179.838 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.774 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 10.2 t -87.83 -33.2 18.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.223 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.466 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.48 -37.48 78.35 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 176.766 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.2 t -68.0 -34.73 77.08 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.739 177.307 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.774 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 12.0 mtm -64.21 -36.49 84.25 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.912 177.577 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.692 ' HA ' ' HE2' ' A' ' 23' ' ' MET . 4.1 mp -52.15 -48.68 64.77 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.117 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.03 -30.89 71.5 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.022 178.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.5 p -101.37 19.5 17.66 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.54 -178.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.579 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -135.36 119.56 13.25 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.21 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_exo -56.02 167.54 2.35 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.617 2.211 . . . . 0.0 112.051 179.491 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_exo -56.29 -38.19 95.53 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.454 2.102 . . . . 0.0 112.422 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -73.32 -11.42 60.49 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.129 -179.648 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.579 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.9 OUTLIER -85.79 12.44 9.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.83 -179.963 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.477 ' O ' HD12 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -52.18 -57.61 9.11 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.372 -179.77 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.538 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.9 -20.37 15.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.539 -178.608 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.568 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 5.0 tp60 -73.2 -79.46 0.08 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.873 0.368 . . . . 0.0 111.341 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.692 ' HE2' ' HA ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.87 -94.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -176.682 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.59 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -60.88 1.94 0.13 Allowed 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 113.682 0.993 . . . . 0.0 113.682 -174.876 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.86 -117.01 9.63 Favored Glycine 0 N--CA 1.445 -0.759 0 N-CA-C 108.359 -1.896 . . . . 0.0 108.359 -174.381 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.565 ' HG2' HG22 ' A' ' 50' ' ' ILE . 0.3 OUTLIER -75.49 -68.51 0.56 Allowed 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 107.24 -1.392 . . . . 0.0 107.24 168.572 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.872 ' HG2' HD12 ' A' ' 59' ' ' LEU . 3.6 tpt85 -160.34 9.37 0.1 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.303 -1.317 . . . . 0.0 108.223 174.643 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.966 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.3 OUTLIER -58.73 -72.89 0.09 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 114.407 -1.27 . . . . 0.0 113.893 -173.244 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.647 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -36.01 -49.0 1.57 Allowed Pre-proline 0 CA--C 1.539 0.546 0 N-CA-C 113.318 0.858 . . . . 0.0 113.318 -175.454 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.538 ' O ' ' HB3' ' A' ' 33' ' ' GLN . 51.4 Cg_exo -59.39 -42.12 51.86 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.39 2.06 . . . . 0.0 113.573 -178.72 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.847 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.52 -46.84 62.87 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 120.458 -0.497 . . . . 0.0 109.987 -178.627 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.614 HD11 HD23 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -74.57 -12.95 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.589 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.056 177.913 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.667 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 1.1 tt0 -62.46 -39.19 92.58 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 176.904 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.85 -30.5 69.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.432 -0.804 . . . . 0.0 108.881 174.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.53 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 7.4 mtt -100.3 26.0 7.02 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.254 177.911 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.667 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.7 p-80 -64.98 -32.22 6.37 Favored Pre-proline 0 CA--C 1.536 0.418 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -177.939 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.614 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 42.8 Cg_exo -33.65 -35.47 0.08 OUTLIER 'Trans proline' 0 C--N 1.365 1.405 0 C-N-CA 122.288 1.992 . . . . 0.0 112.133 179.212 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.486 ' HB ' ' H ' ' A' ' 39' ' ' LEU . 2.7 m -78.1 -88.87 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.458 175.877 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.531 ' HB3' ' CD1' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -171.79 66.6 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.723 -0.217 . . . . 0.0 111.399 177.668 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.521 ' HB1' ' HB ' ' A' ' 32' ' ' ILE . . . -48.13 -32.67 7.21 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.565 179.561 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.647 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -46.41 -60.26 4.8 Favored Glycine 0 CA--C 1.518 0.256 0 CA-C-N 115.988 -0.551 . . . . 0.0 114.384 -178.283 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.858 ' HE3' ' HG3' ' B' ' 12' ' ' GLU . 4.4 tptm -77.27 -33.23 55.91 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.938 0.369 . . . . 0.0 111.943 -177.364 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.602 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 29.9 mt -54.01 -57.67 5.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.739 -0.21 . . . . 0.0 111.062 -179.212 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.966 ' HA ' HD22 ' A' ' 28' ' ' LEU . 9.3 t -50.16 -42.61 51.31 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.889 0.376 . . . . 0.0 110.244 178.58 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.89 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -49.35 -67.13 1.88 Allowed Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.681 -0.691 . . . . 0.0 113.296 -179.822 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.724 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.4 -47.26 76.16 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.74 0.27 . . . . 0.0 111.488 -178.157 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.445 ' O ' ' HB ' ' A' ' 50' ' ' ILE . 3.0 mm? -79.87 6.07 12.1 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -178.538 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.594 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.94 -10.58 40.3 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.915 0.388 . . . . 0.0 110.507 179.836 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.447 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 1.6 mm-40 -82.37 21.36 0.95 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.232 177.458 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.613 HD11 ' HE3' ' A' ' 68' ' ' LYS . 0.4 OUTLIER -83.53 160.73 3.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.991 -179.377 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.481 ' HB2' ' HG3' ' A' ' 54' ' ' GLU . 0.9 OUTLIER -70.87 156.61 39.36 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.658 -178.835 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.922 ' HA ' HD23 ' A' ' 55' ' ' LEU . 14.4 m-80 -85.85 -27.87 24.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.197 178.037 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.82 -34.32 64.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.153 0.501 . . . . 0.0 109.769 177.672 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.539 ' O ' ' HG2' ' A' ' 58' ' ' MET . 4.5 mt-10 -76.43 -29.22 56.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.79 179.187 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.922 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -58.98 -45.92 89.39 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.959 0.409 . . . . 0.0 109.961 179.495 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.548 ' HA ' HD11 ' A' ' 59' ' ' LEU . 0.4 OUTLIER -60.25 -44.35 95.34 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.668 179.453 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -64.96 -13.68 58.05 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.057 179.626 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.687 ' SD ' ' HE2' ' A' ' 68' ' ' LYS . 31.7 mmt -76.29 -56.91 4.21 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.466 -179.691 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.872 HD12 ' HG2' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -67.1 -8.57 31.69 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 121.105 0.479 . . . . 0.0 110.429 178.927 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.541 ' N ' HD22 ' A' ' 59' ' ' LEU . 1.1 tp10 -98.61 -16.42 19.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.502 179.188 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.511 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 1.2 t -122.71 87.97 49.94 Favored Pre-proline 0 C--N 1.332 -0.153 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.373 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -60.22 -31.57 93.24 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.345 2.03 . . . . 0.0 111.89 179.052 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.462 ' O ' ' HB2' ' A' ' 67' ' ' SER . 6.9 mm-40 -77.87 -50.34 12.45 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.475 -179.693 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 67.8 m -69.38 -53.31 20.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.444 -178.558 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.847 HD21 HD13 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -57.99 -62.56 1.72 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.645 -178.177 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.679 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -49.93 -35.68 24.83 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.022 -177.639 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.506 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.2 OUTLIER -69.59 -36.14 75.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.159 0.504 . . . . 0.0 110.048 178.046 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.813 ' HG2' HD21 ' B' ' 6' ' ' LEU . 0.1 OUTLIER -66.4 -53.88 30.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.659 179.248 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.559 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 40.0 t -68.05 -19.08 24.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.317 178.537 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.694 ' O ' HG22 ' A' ' 73' ' ' VAL . 19.4 t0 -55.68 -48.75 74.54 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 176.596 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.522 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 1.2 tp10 -69.05 -26.34 64.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.739 176.53 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.602 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -60.78 -47.94 84.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.924 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.694 HG22 ' O ' ' A' ' 70' ' ' ASP . 4.9 m -60.2 -28.33 41.41 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.156 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 177.108 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.522 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -71.43 -30.26 65.85 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.133 178.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.599 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -69.12 -36.16 71.99 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 CA-C-O 120.812 0.339 . . . . 0.0 110.476 179.592 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.646 HD12 ' HB3' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -71.73 -56.32 6.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.939 179.782 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.458 ' NE2' ' HB2' ' A' ' 78' ' ' ALA . 4.6 pp0? -52.41 -36.66 54.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.134 0.492 . . . . 0.0 110.332 179.794 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.458 ' HB2' ' NE2' ' A' ' 77' ' ' GLN . . . -80.8 -24.38 38.58 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.756 178.453 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.584 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 77.2 t60 -65.15 -55.61 17.65 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.727 179.605 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -78.86 2.47 19.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.008 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.85 -71.62 0.24 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.207 -179.725 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.12 -13.81 59.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.258 -179.428 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.584 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 0.3 OUTLIER -76.09 -40.05 53.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.953 -179.892 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.77 -36.44 83.87 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.972 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -84.07 -6.69 59.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.862 179.59 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.61 -58.43 2.58 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.886 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -77.41 -61.46 1.98 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.98 -179.89 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -88.43 86.75 7.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.197 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.1 t -85.94 63.94 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.909 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 58.2 m-20 -80.37 138.35 36.67 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.95 -179.757 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.99 -66.83 0.89 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.911 179.847 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -83.25 142.41 31.15 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.033 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -103.69 168.33 9.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.912 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -99.74 85.49 0.65 Allowed Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.388 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.424 ' HA ' ' HD3' ' A' ' 96' ' ' PRO . 4.3 p -92.43 124.61 58.81 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 120.728 0.299 . . . . 0.0 111.039 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 95' ' ' VAL . 68.8 Cg_endo -89.77 -66.21 0.01 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.707 0 C-N-CA 122.856 2.371 . . . . 0.0 112.757 -179.247 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.91 174.24 9.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.94 -179.676 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 12.0 p . . . . . 0 C--O 1.249 1.054 0 CA-C-O 117.914 -1.041 . . . . 0.0 111.089 179.926 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.803 0.335 . . . . 0.0 111.007 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.4 p -94.46 153.58 3.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.019 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.54 77.39 2.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.918 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 4' ' ' SER . . . . . 0.415 ' HB2' ' O ' ' B' ' 7' ' ' ASN . 0.0 OUTLIER -82.43 172.06 13.47 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.841 -179.877 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 20.9 m120 -107.02 -67.27 0.96 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.32 -179.136 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.813 HD21 ' HG2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -62.57 -73.34 0.11 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.006 -179.394 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 7' ' ' ASN . . . . . 0.415 ' O ' ' HB2' ' B' ' 4' ' ' SER . 1.4 t-20 -90.5 128.78 47.48 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.186 -179.636 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -77.79 -1.07 11.25 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.259 1.972 . . . . 0.0 111.798 178.501 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 9' ' ' ASN . . . . . 0.582 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 26.6 m120 -123.41 52.12 1.43 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.682 179.749 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 10' ' ' ALA . . . . . 0.724 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.41 98.25 0.06 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.892 -179.553 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.582 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 2.7 mmtm -121.97 141.32 51.44 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.54 178.344 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 12' ' ' GLU . . . . . 0.858 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 17.2 mp0 -50.24 162.4 0.22 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.948 0.404 . . . . 0.0 111.999 -179.058 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 13' ' ' PHE . . . . . 0.89 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.9 OUTLIER -88.09 82.87 7.07 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.614 177.809 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 14' ' ' VAL . . . . . 0.787 HG23 ' HD3' ' B' ' 15' ' ' PRO . 1.2 m -127.89 -34.81 0.04 OUTLIER Pre-proline 0 CA--C 1.539 0.52 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 -175.793 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 15' ' ' PRO . . . . . 0.787 ' HD3' HG23 ' B' ' 14' ' ' VAL . 99.7 Cg_exo -45.01 -33.42 7.69 Favored 'Trans proline' 0 C--N 1.357 1.004 0 C-N-CA 121.832 1.688 . . . . 0.0 112.777 -179.073 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.33 -33.43 2.02 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.468 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.479 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 1.6 m -94.85 -175.19 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.688 0.28 . . . . 0.0 110.648 179.548 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.9 96.25 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.808 -179.585 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.457 ' CG ' ' HG2' ' B' ' 15' ' ' PRO . 0.6 OUTLIER -80.9 100.48 8.9 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.983 -179.494 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 74.32 76.69 0.7 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.351 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 21' ' ' ASN . . . . . 0.614 ' HA ' HD21 ' A' ' 52' ' ' ASN . 0.4 OUTLIER -100.16 -37.95 8.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.95 0.405 . . . . 0.0 111.105 -179.566 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 22' ' ' ILE . . . . . 0.514 HG12 ' ND2' ' B' ' 21' ' ' ASN . 19.2 pt . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.184 -0.912 . . . . 0.0 111.203 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.24 0 N-CA-C 112.489 -0.244 . . . . 0.0 112.489 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_exo -56.98 -58.74 0.81 Allowed 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.535 2.156 . . . . 0.0 112.246 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -77.99 119.13 21.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.973 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -97.1 -23.37 14.99 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.571 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.435 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 0.3 OUTLIER -89.08 140.78 29.03 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-O 120.58 0.228 . . . . 0.0 110.893 179.909 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 5' ' ' SER . 35.3 Cg_exo -60.0 146.2 96.54 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.513 2.142 . . . . 0.0 112.223 -179.77 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.468 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.0 OUTLIER -86.65 127.23 34.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.814 179.792 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.767 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 8.9 t -87.9 -29.36 20.92 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.503 -179.623 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.406 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.32 -39.4 82.97 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 176.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 10.9 t -69.69 -33.63 72.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.763 177.224 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.767 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.4 mtm -64.29 -37.04 86.08 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 116.169 -0.469 . . . . 0.0 109.888 177.726 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.761 HD11 ' HB3' ' A' ' 24' ' ' LEU . 1.4 mp -52.0 -51.83 54.66 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.205 179.125 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.22 -31.92 73.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.441 178.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.57 23.61 10.93 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.343 -0.39 . . . . 0.0 112.002 -178.137 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.601 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -138.15 118.4 10.07 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 120.555 0.217 . . . . 0.0 111.285 179.582 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.43 168.96 1.25 Allowed 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.511 2.141 . . . . 0.0 111.961 179.141 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.81 -33.73 98.65 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.31 2.007 . . . . 0.0 112.299 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -73.41 -9.53 58.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.031 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.69 ' HG3' ' HB3' ' A' ' 22' ' ' GLN . 5.8 tp10 -89.68 11.35 20.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.074 -179.536 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.405 ' O ' HD23 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -52.05 -58.36 6.76 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.387 -179.908 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.576 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.93 -21.81 22.67 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.543 -178.242 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.69 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 20.8 tp60 -73.39 -80.27 0.07 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.992 0.425 . . . . 0.0 111.654 179.683 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.626 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.62 -94.94 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -176.7 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.761 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -59.96 -1.34 0.28 Allowed 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 -174.819 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.577 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 65.06 -116.93 9.47 Favored Glycine 0 N--CA 1.446 -0.648 0 N-CA-C 108.501 -1.84 . . . . 0.0 108.501 -174.54 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.465 ' HB3' ' HB2' ' A' ' 55' ' ' LEU . 0.7 OUTLIER -76.2 -67.23 0.7 Allowed 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 169.592 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.849 ' HG3' HD21 ' A' ' 31' ' ' LEU . 6.5 tpt180 -159.65 7.06 0.1 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.247 -1.342 . . . . 0.0 108.06 175.878 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.92 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.3 OUTLIER -59.19 -78.06 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.441 -1.254 . . . . 0.0 114.26 -172.906 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.615 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -32.88 -48.84 0.58 Allowed Pre-proline 0 CA--C 1.541 0.601 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -175.099 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.592 ' CD ' ' HB2' ' A' ' 24' ' ' LEU . 20.1 Cg_endo -63.44 -39.33 37.31 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.336 2.024 . . . . 0.0 113.817 -178.107 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 1.001 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.44 -45.48 65.72 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 119.997 -0.681 . . . . 0.0 109.506 179.981 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.511 HD11 HD23 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -73.46 -13.29 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.688 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.698 177.46 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.652 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -62.52 -38.1 88.63 Favored 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 177.213 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.41 -28.98 65.49 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 174.673 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.57 ' HE2' HH11 ' A' ' 66' ' ' ARG . 7.8 mtt -100.16 25.61 7.32 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.087 177.858 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.652 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -64.62 -31.49 5.75 Favored Pre-proline 0 CA--C 1.536 0.422 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 -177.471 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.611 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 35.7 Cg_exo -33.31 -34.98 0.07 OUTLIER 'Trans proline' 0 C--N 1.364 1.352 0 C-N-CA 122.339 2.026 . . . . 0.0 112.034 178.709 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.492 ' HB ' ' H ' ' A' ' 39' ' ' LEU . 0.2 OUTLIER -78.01 -90.99 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 175.383 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.492 ' H ' ' HB ' ' A' ' 38' ' ' THR . 0.1 OUTLIER -171.88 67.07 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.649 -0.251 . . . . 0.0 111.307 177.163 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.536 ' HA ' HD12 ' A' ' 43' ' ' ILE . . . -46.38 -28.74 1.43 Allowed 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.922 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.615 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -50.45 -62.08 5.43 Favored Glycine 0 CA--C 1.518 0.27 0 CA-C-N 116.172 -0.467 . . . . 0.0 113.941 -178.375 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.558 ' HE3' ' HG3' ' B' ' 12' ' ' GLU . 4.6 tptm -74.95 -33.71 61.96 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.021 0.378 . . . . 0.0 112.021 -177.299 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.655 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 30.5 mt -54.36 -57.37 6.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.432 -178.711 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.92 ' HA ' HD22 ' A' ' 28' ' ' LEU . 9.0 t -51.2 -45.52 61.88 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.898 0.38 . . . . 0.0 110.519 178.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.624 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -49.66 -64.8 3.2 Favored Glycine 0 N--CA 1.451 -0.311 0 CA-C-N 115.689 -0.687 . . . . 0.0 113.282 -179.452 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.541 ' HB2' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.64 -47.57 76.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.83 0.315 . . . . 0.0 111.79 -178.374 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.418 HD22 ' HG3' ' A' ' 46' ' ' MET . 3.5 mm? -80.18 6.58 11.35 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.649 0.24 . . . . 0.0 111.649 -178.733 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.624 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.17 -7.01 15.4 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.989 0.423 . . . . 0.0 110.77 179.897 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.434 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 3.2 mt-10 -81.67 16.85 1.61 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.295 177.779 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -83.1 160.78 3.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.112 -179.187 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.464 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 1.5 m-20 -71.11 158.17 36.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.805 -178.765 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.821 ' HA ' HD23 ' A' ' 55' ' ' LEU . 12.2 m-80 -86.69 -28.97 22.8 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.841 177.431 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.75 -32.62 63.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.37 0.605 . . . . 0.0 109.519 177.08 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.464 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -75.7 -28.59 58.66 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.564 179.168 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.821 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -60.52 -47.22 87.12 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.002 0.429 . . . . 0.0 110.348 179.533 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.451 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 52.1 tp -58.1 -43.69 87.23 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.555 179.603 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.475 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 1.7 t-80 -59.37 -41.29 88.98 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.67 179.122 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.543 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -61.21 -38.68 87.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.353 178.933 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.555 HD12 ' CZ ' ' A' ' 27' ' ' ARG . 7.3 tt -68.11 -20.36 64.92 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.349 178.541 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.475 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 2.2 pt-20 -107.02 -2.62 20.92 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.458 -179.274 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.581 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 15.9 m -122.52 88.37 49.42 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.251 -178.837 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -62.19 -31.96 82.72 Favored 'Trans proline' 0 C--N 1.343 0.258 0 C-N-CA 122.1 1.867 . . . . 0.0 111.688 178.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.564 ' O ' ' HB2' ' A' ' 67' ' ' SER . 5.0 mt-10 -78.45 -50.44 11.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.765 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.9 t -69.17 -52.38 28.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.082 0.468 . . . . 0.0 111.424 -178.233 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 1.001 HD21 HD13 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -58.13 -64.3 0.96 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.62 -177.882 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.624 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -51.13 -35.04 33.6 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.195 -177.553 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.564 ' HB2' ' O ' ' A' ' 63' ' ' GLU . 0.2 OUTLIER -69.7 -36.41 75.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.9 0.381 . . . . 0.0 110.315 178.428 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -66.32 -56.45 11.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.318 179.005 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.558 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 45.3 t -64.56 -21.07 28.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.492 179.039 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.662 ' O ' HG22 ' A' ' 73' ' ' VAL . 26.7 t70 -56.35 -48.4 76.87 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 176.713 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.473 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 0.8 OUTLIER -68.9 -26.76 65.26 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.751 176.449 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.655 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -60.58 -46.62 89.54 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.527 -0.761 . . . . 0.0 111.07 179.898 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.662 HG22 ' O ' ' A' ' 70' ' ' ASP . 3.6 m -61.24 -29.5 45.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 177.392 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.473 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -70.32 -28.41 65.14 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.151 179.248 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.581 HG22 ' O ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -69.87 -36.58 70.06 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.171 0 CA-C-O 120.811 0.338 . . . . 0.0 110.571 179.544 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.481 ' CD1' ' HB3' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -71.49 -53.99 12.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.134 -179.917 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.469 ' HG3' ' O ' ' A' ' 74' ' ' ALA . 0.0 OUTLIER -52.58 -37.97 59.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.272 0.558 . . . . 0.0 110.283 -179.965 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.11 -21.9 42.73 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.762 178.487 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.525 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 31.7 t60 -70.69 -54.98 9.79 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.133 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -67.68 -5.1 14.26 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.416 -179.301 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -71.59 -65.85 0.7 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.262 -179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.2 -4.17 52.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.369 -179.631 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.525 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 0.1 OUTLIER -84.78 -48.31 9.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.11 -179.74 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -72.57 -2.79 21.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.191 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.18 -45.13 89.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.979 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.435 ' HG2' ' H ' ' A' ' 86' ' ' GLN . 7.4 pt20 -89.07 103.45 16.06 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.861 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 11.7 mtmm -94.08 25.9 3.52 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.887 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -87.52 67.07 9.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.165 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.411 ' O ' HG13 ' A' ' 89' ' ' VAL . 3.0 p -101.68 84.78 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.206 0.527 . . . . 0.0 110.899 179.807 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -104.65 12.41 32.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.934 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.13 0.43 56.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.035 -179.713 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.28 -167.91 0.86 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.075 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 1.4 p -113.67 -166.75 1.12 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.01 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -77.19 -100.44 0.17 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.833 -0.698 . . . . 0.0 112.623 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 3.2 t -83.75 110.14 23.14 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-O 120.593 0.235 . . . . 0.0 111.181 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -75.84 73.74 4.68 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.901 2.401 . . . . 0.0 112.221 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -103.05 95.72 6.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.844 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.0 m . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.043 -0.979 . . . . 0.0 111.22 -179.651 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 29.0 m . . . . . 0 N--CA 1.487 1.403 0 CA-C-O 120.786 0.327 . . . . 0.0 110.893 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 11.9 p -96.08 151.43 4.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.224 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 24.8 mttm -77.39 -143.16 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.041 178.036 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 4' ' ' SER . . . . . 0.664 ' HB2' ' HB2' ' B' ' 10' ' ' ALA . 6.0 t -79.7 -177.11 5.72 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.824 0.345 . . . . 0.0 111.208 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -103.87 -49.53 3.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.706 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 7.9 mt -66.7 -69.11 0.33 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.459 179.137 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 7' ' ' ASN . . . . . 0.494 ' HA ' ' HD3' ' B' ' 8' ' ' PRO . 1.4 t-20 -94.68 129.38 36.46 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.961 179.115 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.494 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 3.6 Cg_exo -76.49 -4.8 15.46 Favored 'Trans proline' 0 N--CA 1.462 -0.358 0 C-N-CA 122.563 2.175 . . . . 0.0 112.344 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -123.61 48.7 1.82 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.986 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 10' ' ' ALA . . . . . 0.664 ' HB2' ' HB2' ' B' ' 4' ' ' SER . . . -55.44 97.19 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.616 -179.399 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.542 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -122.71 134.07 54.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.039 178.975 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 12' ' ' GLU . . . . . 0.558 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 11.5 tt0 -49.17 173.22 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -177.709 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 13' ' ' PHE . . . . . 0.505 ' CE1' ' HG ' ' A' ' 48' ' ' LEU . 0.2 OUTLIER -86.94 77.12 9.28 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.712 179.005 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 14' ' ' VAL . . . . . 0.842 ' H ' ' HD2' ' B' ' 15' ' ' PRO . 0.9 OUTLIER -109.5 -37.87 0.13 Allowed Pre-proline 0 C--N 1.323 -0.571 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.331 -176.303 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 15' ' ' PRO . . . . . 0.842 ' HD2' ' H ' ' B' ' 14' ' ' VAL . 11.7 Cg_endo -54.82 -45.74 38.67 Favored 'Trans proline' 0 C--N 1.356 0.923 0 C-N-CA 121.948 1.766 . . . . 0.0 112.552 -178.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 83.69 -26.27 4.77 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.254 -179.563 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.732 HG22 ' H ' ' B' ' 18' ' ' LYS . 1.9 p -94.88 -175.51 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 110.433 -0.21 . . . . 0.0 110.433 179.437 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.732 ' H ' HG22 ' B' ' 17' ' ' VAL . 15.9 mttt -59.66 89.84 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.85 0.357 . . . . 0.0 110.857 -179.598 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.542 ' CE2' ' HG2' ' B' ' 11' ' ' LYS . 1.1 t80 -85.53 120.94 27.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.994 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 89.59 30.98 12.01 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.228 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 59.5 t30 -94.0 161.9 14.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.653 0.263 . . . . 0.0 110.922 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 2.8 tp . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.251 -0.881 . . . . 0.0 111.05 -179.972 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.217 0 N-CA-C 112.518 -0.233 . . . . 0.0 112.518 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.532 ' HA ' ' HG3' ' A' ' 6' ' ' PRO . 49.6 Cg_exo -55.79 108.38 0.32 Allowed 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.63 2.22 . . . . 0.0 112.294 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.7 tp -75.62 -69.25 0.5 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.905 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -91.46 -98.37 1.27 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.422 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.661 ' N ' ' HA ' ' A' ' 6' ' ' PRO . 1.7 t -82.58 -41.03 0.9 Allowed Pre-proline 0 CA--C 1.538 0.495 0 N-CA-C 111.892 0.33 . . . . 0.0 111.892 179.771 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.661 ' HA ' ' N ' ' A' ' 5' ' ' SER . 8.3 Cg_exo -71.41 149.06 91.46 Favored 'Cis proline' 0 C--N 1.359 1.099 0 CA-C-N 119.627 0.902 . . . . 0.0 112.565 -1.79 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.443 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.0 OUTLIER -89.76 170.59 10.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.816 179.967 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.774 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 15.0 t -88.21 -30.29 19.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.399 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.24 -35.65 74.04 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 176.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 40.7 t -72.91 -34.29 66.52 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.894 177.405 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.774 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 10.6 mtm -64.15 -35.86 82.17 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.804 177.652 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.704 ' HA ' ' HE2' ' A' ' 23' ' ' MET . 5.6 mp -52.9 -55.63 21.83 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.995 178.273 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.9 -24.73 66.9 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.686 178.022 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.7 m -101.52 25.07 8.82 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.477 -179.222 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.74 ' HB1' ' HB2' ' A' ' 19' ' ' GLU . . . -134.07 61.66 52.46 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.889 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.508 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 51.0 Cg_exo -53.99 -49.94 15.37 Favored 'Trans proline' 0 CA--C 1.536 0.59 0 C-N-CA 122.781 2.321 . . . . 0.0 113.698 -178.438 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.508 ' HD3' ' HB2' ' A' ' 16' ' ' PRO . 16.7 Cg_exo -67.19 -167.62 0.15 Allowed 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 122.061 1.841 . . . . 0.0 112.076 -179.423 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.8 mm100 -74.36 60.11 0.83 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.744 178.771 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.74 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 2.8 mm-40 -89.56 9.41 26.8 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.015 -179.16 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.454 ' O ' HD12 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -46.35 -64.51 0.74 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.894 0.378 . . . . 0.0 110.997 -179.039 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.638 ' HD2' ' HA ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER -56.49 -23.14 37.31 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.313 -179.512 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.502 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 2.7 tp60 -73.47 -75.98 0.14 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.771 0.32 . . . . 0.0 111.538 179.555 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.704 ' HE2' ' HA ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -68.99 -96.58 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 112.613 0.598 . . . . 0.0 112.613 -176.332 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.648 HD22 ' HD3' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -62.13 3.08 0.19 Allowed 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -175.309 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.49 -117.28 10.29 Favored Glycine 0 N--CA 1.445 -0.761 0 N-CA-C 108.258 -1.937 . . . . 0.0 108.258 -174.456 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.526 ' O ' HD13 ' A' ' 24' ' ' LEU . 0.4 OUTLIER -75.49 -69.34 0.49 Allowed 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 168.609 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.787 ' NE ' HD12 ' A' ' 59' ' ' LEU . 9.9 tpt85 -160.44 10.08 0.1 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.188 -1.369 . . . . 0.0 107.768 174.164 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.951 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.09 -71.62 0.12 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 114.549 -1.205 . . . . 0.0 113.728 -173.14 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.639 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -36.28 -48.92 1.69 Allowed Pre-proline 0 CA--C 1.54 0.583 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -176.24 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.656 ' HB2' ' NH1' ' A' ' 27' ' ' ARG . 42.6 Cg_exo -61.4 -41.12 43.35 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 122.511 2.141 . . . . 0.0 113.874 -178.174 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.907 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -69.98 -45.94 66.25 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.359 0.6 . . . . 0.0 109.556 -179.094 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.826 HD11 HD23 ' A' ' 28' ' ' LEU . 0.7 OUTLIER -75.96 -12.09 14.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.021 177.381 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.639 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 6.0 tp60 -62.44 -38.86 91.4 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.315 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.76 -31.22 70.11 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 174.769 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.499 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 5.7 mtt -100.23 27.35 5.72 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.261 178.121 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.639 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -64.92 -32.71 7.04 Favored Pre-proline 0 CA--C 1.536 0.405 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -177.171 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.554 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 61.5 Cg_exo -37.12 -30.39 0.11 Allowed 'Trans proline' 0 C--N 1.36 1.178 0 C-N-CA 122.187 1.925 . . . . 0.0 112.36 179.618 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.848 HG21 HG13 ' A' ' 73' ' ' VAL . 37.2 m -78.65 -84.62 0.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.183 177.42 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.452 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.4 OUTLIER -171.12 49.84 0.03 OUTLIER 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.39 179.219 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.471 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -38.23 -38.11 0.33 Allowed 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.378 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.639 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -51.29 -55.49 19.11 Favored Glycine 0 CA--C 1.518 0.226 0 C-N-CA 121.248 -0.501 . . . . 0.0 113.789 -179.185 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.828 ' HB3' HD11 ' A' ' 76' ' ' LEU . 3.5 tptm -77.18 -32.21 55.94 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -177.902 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.8 HD12 HG21 ' A' ' 32' ' ' ILE . 0.5 OUTLIER -54.96 -56.55 10.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.121 -179.255 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.951 ' HA ' HD22 ' A' ' 28' ' ' LEU . 11.8 t -51.37 -44.52 62.13 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.616 179.566 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.763 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -48.63 -68.86 1.13 Allowed Glycine 0 C--O 1.227 -0.297 0 CA-C-N 115.917 -0.583 . . . . 0.0 113.321 -179.376 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.605 ' SD ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.41 -46.76 76.61 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -178.192 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.412 HD22 ' N ' ' A' ' 47' ' ' LEU . 3.4 mm? -80.31 7.93 8.53 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -178.911 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.634 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.94 -13.97 60.71 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.86 0.362 . . . . 0.0 110.767 179.894 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.544 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.0 mt-10 -78.6 19.18 0.5 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.731 178.629 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.764 HD11 ' NZ ' ' A' ' 68' ' ' LYS . 1.2 tt -83.22 163.97 2.84 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.982 -179.783 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.476 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 1.8 m-20 -71.25 156.37 39.62 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.836 -179.108 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.831 ' HA ' HD23 ' A' ' 55' ' ' LEU . 3.2 m120 -87.12 -28.21 22.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.75 176.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.7 m -74.14 -30.99 62.55 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 176.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.476 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.6 OUTLIER -75.4 -31.17 60.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.31 178.926 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.831 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.5 OUTLIER -59.28 -45.98 89.77 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.404 179.845 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.468 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 38.6 tp -58.8 -44.24 90.72 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.817 179.438 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.466 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 4.6 m80 -65.04 -38.73 91.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.126 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.563 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -60.62 -38.02 83.34 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.101 0.477 . . . . 0.0 110.14 178.828 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.787 HD12 ' NE ' ' A' ' 27' ' ' ARG . 7.6 tt -69.61 -20.25 63.63 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.411 178.837 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 57' ' ' HIS . 4.3 pt-20 -106.91 -1.45 22.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.517 -179.34 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.594 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 5.9 m -122.95 78.91 50.52 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.223 -179.556 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.452 ' O ' ' HB2' ' A' ' 66' ' ' ARG . 50.5 Cg_exo -55.69 -33.19 86.67 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.243 1.962 . . . . 0.0 111.993 179.408 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -78.21 -50.39 12.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.824 -179.363 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.594 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 50.2 m -70.43 -51.35 30.04 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.92 0.391 . . . . 0.0 111.535 -177.793 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.907 HD21 HD13 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -57.81 -59.33 5.39 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.282 -178.658 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.645 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -52.51 -30.46 30.41 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.796 -178.379 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.539 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.4 OUTLIER -69.44 -38.33 77.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.106 0.479 . . . . 0.0 110.134 178.005 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.764 ' NZ ' HD11 ' A' ' 50' ' ' ILE . 5.7 mtpp -65.65 -59.01 4.38 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.287 178.661 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.515 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 52.8 t -61.73 -21.53 26.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.606 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.539 ' HB3' ' O ' ' A' ' 67' ' ' SER . 16.2 t70 -54.79 -49.45 70.93 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.78 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -68.84 -30.51 69.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.766 176.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.675 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -57.7 -40.57 79.82 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.105 177.887 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.848 HG13 HG21 ' A' ' 38' ' ' THR . 33.4 t -62.21 -31.11 50.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.526 176.759 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.3 -37.14 66.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.53 179.827 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.516 HG22 ' O ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -58.71 -28.17 36.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.963 0.411 . . . . 0.0 110.159 179.782 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.828 HD11 ' HB3' ' A' ' 42' ' ' LYS . 3.1 mm? -71.35 -53.72 13.2 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.876 178.851 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 20.8 mm100 -51.16 -35.44 35.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.372 179.604 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.56 -26.92 34.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.877 178.494 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.573 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 6.3 t60 -64.59 -50.4 67.36 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.162 -179.514 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -77.08 1.0 19.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.185 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -75.48 -65.14 0.93 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.099 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 9.5 mmtt -80.06 -4.62 53.48 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.168 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.573 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 1.0 OUTLIER -88.88 -42.09 12.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.036 -179.844 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.32 -30.21 71.03 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.049 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.51 -41.98 83.54 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.101 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 19.8 mm100 -82.7 174.42 11.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.873 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -77.56 160.34 28.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.893 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -78.98 75.25 5.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.943 179.617 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -91.09 106.16 17.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.011 -179.756 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -92.98 174.61 7.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.787 179.673 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 4.3 m -88.76 113.73 24.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.924 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -86.65 65.24 8.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.025 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 12.7 p -110.66 -75.03 0.63 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.839 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -106.01 102.42 1.95 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.351 179.74 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 3.2 t -107.95 91.6 7.96 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 120.637 0.256 . . . . 0.0 111.219 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -75.93 -4.21 14.87 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.594 2.196 . . . . 0.0 112.252 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.74 -73.3 0.39 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.022 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.5 t . . . . . 0 C--O 1.249 1.072 0 CA-C-O 117.946 -1.026 . . . . 0.0 111.064 -179.943 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 2.4 p . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 121.08 0.466 . . . . 0.0 110.951 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 2' ' ' VAL . . . . . 0.591 HG21 ' HB3' ' B' ' 10' ' ' ALA . 1.0 OUTLIER -99.77 171.26 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.996 179.846 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.41 42.05 1.09 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.937 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 4' ' ' SER . . . . . 0.448 ' HB3' ' HB2' ' B' ' 10' ' ' ALA . 0.2 OUTLIER -73.37 153.11 40.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.018 -179.909 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 27.5 m-20 -107.7 -60.64 1.68 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.816 179.813 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.18 -85.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.827 179.769 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -74.46 124.29 89.72 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.816 179.571 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -76.59 -0.74 10.77 Favored 'Trans proline' 0 N--CA 1.463 -0.316 0 C-N-CA 122.138 1.892 . . . . 0.0 111.81 179.088 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -123.12 51.15 1.47 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.57 179.437 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 10' ' ' ALA . . . . . 0.591 ' HB3' HG21 ' B' ' 2' ' ' VAL . . . -60.06 97.91 0.05 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.627 -179.687 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.544 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 2.8 mttp -122.85 138.09 54.75 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.498 178.817 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 12' ' ' GLU . . . . . 0.628 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 4.9 mp0 -48.43 166.03 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.026 0.441 . . . . 0.0 112.13 -178.841 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 13' ' ' PHE . . . . . 0.763 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.8 OUTLIER -87.74 86.41 7.17 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.87 -0.604 . . . . 0.0 109.699 178.726 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 14' ' ' VAL . . . . . 0.852 HG23 ' HD3' ' B' ' 15' ' ' PRO . 0.8 OUTLIER -129.56 -36.2 0.03 OUTLIER Pre-proline 0 CA--C 1.541 0.599 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -175.755 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 15' ' ' PRO . . . . . 0.852 ' HD3' HG23 ' B' ' 14' ' ' VAL . 90.4 Cg_exo -45.97 -33.3 10.85 Favored 'Trans proline' 0 C--N 1.357 1.002 0 C-N-CA 121.868 1.712 . . . . 0.0 112.746 -178.809 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 16' ' ' GLY . . . . . 0.512 ' O ' ' HD2' ' A' ' 21' ' ' LYS . . . 80.45 -34.42 2.25 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.462 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.638 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 11.8 m -94.77 -174.67 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.631 0.253 . . . . 0.0 110.743 179.562 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.71 95.13 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.93 0.395 . . . . 0.0 110.775 -179.662 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.509 ' CG ' ' HG2' ' B' ' 15' ' ' PRO . 0.7 OUTLIER -79.1 124.38 28.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.023 -179.28 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 86.5 63.06 1.5 Allowed Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.304 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -98.81 -19.54 17.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.781 0.324 . . . . 0.0 111.087 -179.639 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 9.5 mt . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.271 -0.871 . . . . 0.0 111.044 -179.951 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.17 0 N-CA-C 112.478 -0.249 . . . . 0.0 112.478 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -72.97 132.77 18.77 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.517 2.145 . . . . 0.0 112.35 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -94.15 84.8 4.52 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.914 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -107.05 10.43 40.25 Favored Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.357 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.638 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 5.8 t -86.46 -48.99 0.51 Allowed Pre-proline 0 CA--C 1.533 0.32 0 N-CA-C 111.595 0.22 . . . . 0.0 111.595 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.638 ' HD2' ' N ' ' A' ' 5' ' ' SER . 13.2 Cg_endo -56.3 -22.77 42.71 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 122.354 2.036 . . . . 0.0 112.453 -179.611 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.455 ' O ' ' HG3' ' A' ' 11' ' ' MET . 79.6 mt -86.19 93.23 8.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.773 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.732 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 3.0 t -87.97 -34.59 18.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.624 -179.383 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.49 -34.92 69.57 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 177.533 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.3 t -72.22 -36.76 69.23 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.947 177.444 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.732 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 3.4 mtm -64.59 -37.56 87.99 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.422 178.248 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.792 HD21 ' HB3' ' A' ' 24' ' ' LEU . 65.1 mt -52.76 -50.38 63.62 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.946 179.37 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.39 -26.02 67.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.816 177.642 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.4 m -101.67 15.19 29.7 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.667 -178.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.946 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -134.38 60.59 44.42 Favored Pre-proline 0 CA--C 1.533 0.323 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.745 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.463 ' N ' ' HD2' ' A' ' 17' ' ' PRO . 50.7 Cg_exo -55.02 -50.25 13.82 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 122.829 2.352 . . . . 0.0 114.124 -177.686 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.463 ' HD2' ' N ' ' A' ' 16' ' ' PRO . 42.4 Cg_endo -66.86 -163.19 0.07 OUTLIER 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 122.044 1.829 . . . . 0.0 112.591 -178.522 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -74.5 55.46 0.64 Allowed 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.745 179.07 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.946 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 15.7 tp10 -93.02 10.98 29.12 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.594 -179.489 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.592 ' HG2' ' N ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -50.87 -51.12 54.66 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.326 -179.151 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.676 ' HD2' ' HA ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER -56.37 -26.55 53.29 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.514 -178.327 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.799 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 2.5 tp-100 -73.42 -76.65 0.12 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.92 0.391 . . . . 0.0 111.702 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.651 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -68.99 -97.73 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -176.492 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.792 ' HB3' HD21 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -59.05 -1.37 0.17 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -176.014 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.526 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 65.06 -118.17 11.69 Favored Glycine 0 N--CA 1.442 -0.901 0 N-CA-C 108.524 -1.83 . . . . 0.0 108.524 -174.764 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.475 ' HG2' HG22 ' A' ' 50' ' ' ILE . 0.4 OUTLIER -76.34 -67.07 0.73 Allowed 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 169.737 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.852 ' HG3' HD21 ' A' ' 31' ' ' LEU . 9.5 tpt180 -160.03 10.11 0.11 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 114.507 -1.224 . . . . 0.0 108.403 177.031 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.502 HD12 HD11 ' A' ' 32' ' ' ILE . 4.2 mm? -57.89 -82.41 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.72 -1.127 . . . . 0.0 113.795 -173.005 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.705 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -33.68 -50.0 0.79 Allowed Pre-proline 0 CA--C 1.537 0.471 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -175.071 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.606 ' CD ' ' HB2' ' A' ' 24' ' ' LEU . 12.2 Cg_endo -58.77 -40.6 71.19 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.415 2.076 . . . . 0.0 113.722 -177.612 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.852 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.52 -47.73 59.01 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 120.077 -0.649 . . . . 0.0 109.79 -179.666 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.522 ' O ' ' HB2' ' A' ' 40' ' ' ALA . 0.3 OUTLIER -73.31 -14.1 16.51 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.156 178.647 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.627 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 55.0 tp60 -62.15 -38.64 89.78 Favored 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 177.016 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.9 -31.1 70.64 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.063 174.625 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.541 ' HE1' ' HA ' ' A' ' 66' ' ' ARG . 7.0 mtt -101.24 27.54 6.1 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.317 178.062 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.627 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 2.4 p-80 -64.37 -31.91 6.54 Favored Pre-proline 0 CA--C 1.537 0.458 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 -177.306 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.605 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 49.2 Cg_exo -34.71 -34.96 0.1 OUTLIER 'Trans proline' 0 C--N 1.362 1.257 0 C-N-CA 122.29 1.994 . . . . 0.0 112.411 179.399 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.482 HG22 HD12 ' A' ' 76' ' ' LEU . 31.9 m -78.3 -86.52 0.06 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.189 -0.459 . . . . 0.0 109.869 176.765 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.714 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -171.36 62.32 0.03 OUTLIER 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.364 178.406 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.522 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -48.44 -33.29 9.04 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.784 0.326 . . . . 0.0 111.578 179.534 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.648 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -45.26 -59.41 4.62 Favored Glycine 0 CA--C 1.518 0.24 0 CA-C-N 115.841 -0.618 . . . . 0.0 114.169 -178.262 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.866 ' HZ1' ' HA ' ' B' ' 12' ' ' GLU . 0.1 OUTLIER -78.26 -36.13 47.21 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.332 0.494 . . . . 0.0 112.332 -177.622 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.642 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 20.9 mt -53.06 -53.71 20.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.4 -177.657 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.586 HG21 ' CD2' ' A' ' 29' ' ' PHE . 5.1 t -47.9 -43.04 28.48 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-O 121.153 0.502 . . . . 0.0 109.786 177.736 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.889 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -51.78 -66.38 2.6 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.167 -0.924 . . . . 0.0 113.656 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.641 ' SD ' ' HE3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.33 -47.45 75.64 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -177.225 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.444 HD22 ' N ' ' A' ' 47' ' ' LEU . 3.3 mm? -79.98 3.46 20.0 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 121.145 -0.222 . . . . 0.0 111.564 -178.852 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.526 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.13 -11.6 50.17 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.842 0.354 . . . . 0.0 110.913 179.991 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.421 ' OE1' ' HG3' ' B' ' 11' ' ' LYS . 1.3 mm-40 -77.85 16.36 0.72 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.967 0.413 . . . . 0.0 110.554 178.309 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.488 HD11 ' NZ ' ' A' ' 68' ' ' LYS . 0.3 OUTLIER -83.77 158.77 3.64 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.048 -179.496 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.4 ' O ' HG23 ' A' ' 50' ' ' ILE . 2.2 m-20 -71.25 161.7 30.66 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.817 -179.111 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.926 ' HA ' HD23 ' A' ' 55' ' ' LEU . 3.7 m-80 -83.92 -28.6 27.75 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.125 177.777 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.3 t -73.85 -36.67 64.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.081 -0.508 . . . . 0.0 109.961 178.284 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.426 ' HG2' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -75.71 -23.77 56.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.656 179.548 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.926 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -62.61 -47.15 85.02 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 120.916 0.389 . . . . 0.0 109.967 178.939 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.408 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 38.5 tp -58.12 -43.68 87.33 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.526 179.099 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.519 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 0.4 OUTLIER -57.76 -42.09 83.31 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.804 179.257 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.632 ' SD ' ' HE2' ' A' ' 68' ' ' LYS . 19.9 mmt -60.23 -44.08 95.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.072 0.463 . . . . 0.0 110.329 178.528 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.494 HD22 ' NE ' ' A' ' 27' ' ' ARG . 8.4 tp -68.46 -16.29 63.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.777 179.513 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.519 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 0.1 OUTLIER -106.81 0.32 23.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.95 179.51 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.629 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 5.5 m -125.66 82.7 63.29 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.121 -179.591 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -58.32 -35.28 98.87 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.217 1.945 . . . . 0.0 111.935 179.36 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.463 ' O ' ' HB2' ' A' ' 67' ' ' SER . 31.6 mt-10 -78.3 -47.79 17.06 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.887 -179.21 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.629 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 36.9 m -71.7 -53.12 14.52 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.815 0.34 . . . . 0.0 111.709 -177.779 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.81 HD21 HD13 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -57.94 -62.11 2.05 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.302 -178.476 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.675 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.6 OUTLIER -50.14 -34.05 20.94 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.861 -178.086 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.479 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.5 OUTLIER -69.6 -38.05 77.15 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.105 0.478 . . . . 0.0 110.228 177.806 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.725 ' HG2' HD22 ' B' ' 6' ' ' LEU . 0.2 OUTLIER -65.96 -58.2 6.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.316 178.938 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.542 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 28.0 t -62.99 -18.99 22.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.509 179.037 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.68 ' O ' HG22 ' A' ' 73' ' ' VAL . 25.1 t0 -56.14 -49.1 74.88 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 176.374 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.491 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 0.5 OUTLIER -69.08 -24.71 64.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.765 176.481 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.642 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -63.91 -43.85 94.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.811 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.68 HG22 ' O ' ' A' ' 70' ' ' ASP . 2.5 m -61.35 -29.93 46.95 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 177.15 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -68.41 -38.33 81.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.103 178.82 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.618 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.15 -35.44 52.9 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-O 120.995 0.426 . . . . 0.0 110.042 179.221 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.714 ' HG ' ' HB3' ' A' ' 39' ' ' LEU . 2.6 tm? -69.26 -47.06 65.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.065 178.487 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -54.25 -37.26 64.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.652 179.54 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.24 -23.95 37.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.784 178.815 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 16.0 t-160 -59.23 -69.75 0.19 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.992 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -64.56 -6.51 7.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.228 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.74 -65.14 1.04 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.443 -179.56 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 45.4 mttm -77.32 -22.6 51.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.585 -178.686 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -74.57 -48.22 28.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.695 0.284 . . . . 0.0 110.86 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -71.63 -25.72 62.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.018 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.08 -28.58 68.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.017 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -85.49 -16.36 39.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.878 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -85.24 69.84 10.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.946 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -79.03 91.03 4.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.146 -179.76 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -103.9 -37.55 4.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.996 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -96.43 -26.72 15.22 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.86 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -86.19 117.59 25.11 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.915 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -92.32 84.96 5.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.005 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.79 -67.81 0.95 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.931 -179.842 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -97.57 49.38 1.46 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.42 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 11.5 p -86.72 133.01 40.63 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-O 120.549 0.214 . . . . 0.0 111.007 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -78.45 59.02 6.97 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.618 2.212 . . . . 0.0 112.504 -179.413 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 43.7 m -107.8 -49.69 3.18 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.906 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.025 -0.988 . . . . 0.0 111.042 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 13.0 p . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.817 0.341 . . . . 0.0 111.046 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 8.2 t -95.61 119.49 43.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.99 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 6.4 mtpm? -77.78 130.67 37.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.944 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 8.9 t -79.74 174.72 11.3 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.964 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 24.1 m-20 -104.21 -52.75 2.86 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.876 179.778 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.725 HD22 ' HG2' ' A' ' 68' ' ' LYS . 11.9 mt -66.07 -89.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.765 179.72 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 7' ' ' ASN . . . . . 0.452 ' HA ' ' HD3' ' B' ' 8' ' ' PRO . 1.3 t-20 -77.47 119.75 78.7 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.955 179.299 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 9.8 Cg_exo -72.34 0.26 7.66 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.344 2.029 . . . . 0.0 111.953 179.416 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 9' ' ' ASN . . . . . 0.428 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 17.4 m-80 -123.01 45.55 2.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.605 179.494 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 10' ' ' ALA . . . . . 0.639 ' HB1' ' HB2' ' A' ' 46' ' ' MET . . . -59.49 98.45 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.505 -179.377 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.4 OUTLIER -117.25 138.16 51.91 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.666 179.185 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 12' ' ' GLU . . . . . 0.866 ' HA ' ' HZ1' ' A' ' 42' ' ' LYS . 0.4 OUTLIER -50.89 160.82 0.42 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.159 -0.473 . . . . 0.0 112.127 -178.758 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 13' ' ' PHE . . . . . 0.889 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.7 OUTLIER -88.14 89.61 8.06 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.472 177.951 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 14' ' ' VAL . . . . . 0.623 ' H ' ' HD2' ' B' ' 15' ' ' PRO . 21.8 t -124.69 -53.06 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.271 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -176.683 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 15' ' ' PRO . . . . . 0.623 ' HD2' ' H ' ' B' ' 14' ' ' VAL . 98.9 Cg_exo -44.45 -34.3 7.41 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 122.315 2.01 . . . . 0.0 112.811 -178.274 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 16' ' ' GLY . . . . . 0.467 ' O ' ' HD2' ' A' ' 21' ' ' LYS . . . 75.63 -18.23 3.07 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.341 -179.789 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.676 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 12.5 m -94.85 -174.04 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.548 0.214 . . . . 0.0 110.663 179.527 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 12.4 mttm -59.93 95.46 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.894 0.378 . . . . 0.0 110.93 -179.449 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.481 ' CE1' ' HG2' ' B' ' 15' ' ' PRO . 0.1 OUTLIER -81.76 106.86 14.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.842 -179.737 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 90.57 70.74 1.22 Allowed Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.875 -0.678 . . . . 0.0 112.34 -179.647 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -93.36 -19.34 21.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.842 0.353 . . . . 0.0 110.938 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 11.4 mt . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.082 179.955 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.21 0 CA-C-O 120.144 -0.253 . . . . 0.0 112.496 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_exo -72.67 126.65 11.89 Favored 'Cis proline' 0 C--N 1.348 0.55 0 C-N-CA 123.618 -1.409 . . . . 0.0 112.284 0.377 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.82 119.04 22.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.859 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -100.45 -17.84 23.0 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.774 -0.726 . . . . 0.0 112.391 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.4 m -92.73 111.01 49.13 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 120.564 0.221 . . . . 0.0 110.926 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -68.48 107.89 1.71 Allowed 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.476 2.117 . . . . 0.0 112.248 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.457 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.3 OUTLIER -93.9 116.83 29.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.074 -179.847 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.742 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 5.2 t -87.78 -34.72 18.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.35 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.4 -37.68 78.62 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 176.763 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.3 t -66.96 -35.36 79.8 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.805 177.194 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.742 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.5 mtm -64.46 -38.52 91.3 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.19 178.155 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.93 HD21 ' HB3' ' A' ' 24' ' ' LEU . 49.0 mt -52.29 -44.56 65.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.342 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.27 -34.3 77.68 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.96 178.288 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.4 m -101.75 18.49 20.31 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.676 -179.041 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.513 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -140.17 114.76 7.66 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.089 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.458 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 40.0 Cg_exo -56.82 169.45 1.83 Allowed 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.542 2.161 . . . . 0.0 112.09 179.738 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -57.33 -30.16 86.73 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.404 2.07 . . . . 0.0 112.134 179.659 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -72.1 -12.53 61.25 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.953 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.513 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.4 OUTLIER -88.5 6.8 36.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.879 179.996 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.665 ' HG2' ' N ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -48.64 -51.9 25.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.905 -176.8 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.686 ' HD2' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -59.97 -23.29 63.48 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.567 -0.453 . . . . 0.0 111.692 -177.586 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.686 ' N ' ' HD2' ' A' ' 21' ' ' LYS . 5.2 tt0 -73.5 -78.97 0.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.041 0.448 . . . . 0.0 111.682 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.698 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.66 -96.22 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -175.898 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.93 ' HB3' HD21 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -60.77 -2.17 0.51 Allowed 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -174.931 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.68 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.65 -116.52 9.11 Favored Glycine 0 N--CA 1.447 -0.576 0 N-CA-C 108.449 -1.861 . . . . 0.0 108.449 -174.488 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.761 ' HG2' HG22 ' A' ' 50' ' ' ILE . 0.3 OUTLIER -76.28 -68.56 0.57 Allowed 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 168.646 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.871 ' HE ' HD13 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -159.92 9.03 0.1 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.176 -1.374 . . . . 0.0 108.022 174.445 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.982 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.03 -74.39 0.07 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.139 -1.391 . . . . 0.0 113.896 -172.982 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.658 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -35.38 -49.14 1.26 Allowed Pre-proline 0 CA--C 1.538 0.504 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -175.646 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.576 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 52.0 Cg_exo -58.83 -43.35 44.55 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 122.316 2.011 . . . . 0.0 113.648 -178.722 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.779 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.54 -47.2 61.52 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 120.269 -0.572 . . . . 0.0 110.002 -178.509 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.836 HG21 HD12 ' A' ' 43' ' ' ILE . 0.6 OUTLIER -73.43 -12.93 15.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.909 178.073 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.602 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.7 OUTLIER -62.19 -38.54 89.51 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 177.147 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.56 -31.4 70.58 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.039 174.648 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.518 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 6.6 mtt -100.84 27.99 5.55 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.228 178.061 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.602 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 3.7 p-80 -64.9 -31.69 5.77 Favored Pre-proline 0 CA--C 1.536 0.407 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 -177.232 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.554 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 63.0 Cg_exo -37.75 -29.97 0.13 Allowed 'Trans proline' 0 C--N 1.362 1.286 0 C-N-CA 122.137 1.891 . . . . 0.0 112.278 179.236 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.809 HG21 HG13 ' A' ' 73' ' ' VAL . 6.4 m -78.14 -86.11 0.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.04 177.137 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.495 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.3 OUTLIER -171.39 50.52 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.488 -0.323 . . . . 0.0 111.246 178.642 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.44 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -37.78 -36.84 0.2 Allowed 'General case' 0 N--CA 1.467 0.413 0 O-C-N 123.312 0.382 . . . . 0.0 111.92 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.658 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.34 -60.1 5.97 Favored Glycine 0 C--N 1.329 0.173 0 CA-C-N 116.042 -0.526 . . . . 0.0 113.821 -179.409 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.556 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -77.32 -30.47 54.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.983 0.392 . . . . 0.0 111.989 -177.681 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.836 HD12 HG21 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -54.0 -54.95 16.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 C-N-CA 121.077 -0.249 . . . . 0.0 111.155 -179.281 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.982 ' HA ' HD22 ' A' ' 28' ' ' LEU . 10.7 t -51.56 -47.57 63.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.628 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.577 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -49.8 -59.76 7.08 Favored Glycine 0 CA--C 1.518 0.264 0 C-N-CA 121.161 -0.543 . . . . 0.0 113.309 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.549 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -56.32 -53.79 53.08 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.788 0.294 . . . . 0.0 111.475 -178.731 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.581 ' HB2' HD21 ' A' ' 28' ' ' LEU . 2.9 mm? -80.02 10.19 4.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.819 -178.414 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.577 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.99 -17.62 64.8 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.872 0.368 . . . . 0.0 110.731 179.602 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.485 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.0 mm-40 -74.79 17.74 0.2 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.862 179.465 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.761 HG22 ' HG2' ' A' ' 26' ' ' GLU . 0.1 OUTLIER -83.98 160.08 3.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.88 -179.977 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.493 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 1.5 m-20 -70.71 156.82 39.01 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -178.334 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.958 ' HA ' HD23 ' A' ' 55' ' ' LEU . 3.5 m-80 -84.21 -29.62 26.41 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.237 178.153 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.9 m -74.22 -35.18 63.88 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.422 0.629 . . . . 0.0 109.594 177.486 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.493 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -76.58 -21.6 55.39 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.688 179.657 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.958 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.9 OUTLIER -65.66 -47.54 75.16 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-O 121.001 0.429 . . . . 0.0 110.04 178.782 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.431 ' N ' HD12 ' A' ' 55' ' ' LEU . 2.7 tt -56.18 -44.31 79.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.685 179.827 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -56.61 -39.65 73.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.568 -179.503 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.527 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -57.36 -52.82 63.81 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -178.815 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.871 HD13 ' HE ' ' A' ' 27' ' ' ARG . 0.5 OUTLIER -61.53 -19.69 62.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.736 0.303 . . . . 0.0 111.171 -179.364 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -102.57 -6.22 23.05 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.603 178.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.555 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 52.4 m -122.72 81.76 48.65 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.729 -179.757 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.43 ' O ' ' HB2' ' A' ' 66' ' ' ARG . 19.6 Cg_endo -58.01 -30.57 90.45 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.338 2.026 . . . . 0.0 112.189 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -78.4 -50.5 11.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.954 -179.415 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.436 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 73.1 m -74.6 -29.67 61.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.967 -177.539 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.779 HD21 HD13 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -78.68 -60.03 2.54 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.006 -178.329 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.704 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -53.6 -31.72 48.13 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.636 -0.425 . . . . 0.0 110.539 -178.674 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.487 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 3.0 m -67.82 -36.53 80.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.096 177.687 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.495 ' HE2' ' HE2' ' A' ' 58' ' ' MET . 0.3 OUTLIER -65.31 -60.1 3.35 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.973 178.399 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.48 ' CG1' HG23 ' A' ' 32' ' ' ILE . 69.5 t -64.16 -19.71 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.731 -179.629 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.487 ' HB3' ' O ' ' A' ' 67' ' ' SER . 10.9 t70 -55.25 -50.67 68.89 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 176.84 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.442 ' O ' HG13 ' A' ' 75' ' ' VAL . 0.4 OUTLIER -69.22 -30.69 68.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.773 176.777 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.705 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -57.29 -42.41 81.64 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.307 178.299 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.809 HG13 HG21 ' A' ' 38' ' ' THR . 20.9 t -61.8 -31.12 50.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 176.888 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.417 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -73.51 -37.0 65.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.54 179.798 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.565 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.64 -27.81 35.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-O 120.95 0.405 . . . . 0.0 110.207 179.803 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.582 HD21 HG12 ' A' ' 43' ' ' ILE . 3.0 mm? -71.68 -54.85 9.01 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.639 178.526 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 64.3 mm-40 -51.18 -33.23 26.31 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.372 179.49 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.28 -32.76 33.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.745 178.24 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.461 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 71.2 t60 -61.21 -48.46 81.41 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.873 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -83.38 0.71 44.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.066 179.573 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.55 -69.64 0.57 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.394 -179.382 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.12 -4.14 30.81 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.243 -179.313 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.461 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 13.7 tt0 -91.29 -52.92 4.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.044 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -78.2 -8.38 58.25 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.242 -179.648 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -74.35 -58.63 3.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.145 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -86.36 -71.28 0.55 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.026 -179.81 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.08 92.28 4.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.896 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -80.93 -0.15 37.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.187 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -94.96 35.74 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.003 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -78.5 -22.74 46.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.935 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.9 -82.12 0.2 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.098 -179.727 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -81.46 166.23 20.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.085 -179.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -93.68 162.64 13.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.871 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -86.41 56.14 4.73 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.483 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.565 ' N ' ' CD ' ' A' ' 96' ' ' PRO . 9.9 p -84.14 -30.49 0.46 Allowed Pre-proline 0 CA--C 1.54 0.58 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.565 ' CD ' ' N ' ' A' ' 95' ' ' VAL . 96.4 Cg_endo -78.95 126.22 7.03 Favored 'Trans proline' 0 C--N 1.357 1.022 0 C-N-CA 121.783 1.655 . . . . 0.0 112.356 179.663 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 9.2 p -105.84 -76.14 0.61 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.971 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 9.1 m . . . . . 0 C--O 1.25 1.117 0 CA-C-O 118.175 -0.916 . . . . 0.0 111.081 -179.955 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 2.2 t . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.819 0.342 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 36.5 t -81.64 132.86 30.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.949 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 13.3 mtmm -86.46 113.55 22.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.942 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 15.5 t -77.84 -177.58 4.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.862 179.743 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 5' ' ' ASN . . . . . 0.413 ' HB2' ' HG2' ' A' ' 71' ' ' GLU . 25.7 m120 -104.05 -47.96 4.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.847 179.891 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.3 mt -73.11 -78.5 0.09 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.678 179.477 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -84.0 125.18 73.42 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.022 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -77.78 0.54 9.73 Favored 'Trans proline' 0 N--CA 1.461 -0.406 0 C-N-CA 122.195 1.93 . . . . 0.0 112.038 178.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 9' ' ' ASN . . . . . 0.482 ' HB3' ' NZ ' ' B' ' 11' ' ' LYS . 55.9 m-80 -123.44 49.63 1.68 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.796 179.66 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 10' ' ' ALA . . . . . 0.549 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.66 97.57 0.06 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.576 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.485 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 0.3 OUTLIER -117.41 167.71 11.02 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.478 178.559 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -67.25 167.93 11.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.691 0.281 . . . . 0.0 110.86 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 13' ' ' PHE . . . . . 0.432 ' CZ ' HD21 ' A' ' 48' ' ' LEU . 1.0 OUTLIER -88.64 117.35 27.54 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.855 -179.61 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 12.0 t -115.43 83.63 10.93 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.551 178.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 15' ' ' PRO . . . . . 0.684 ' HB3' ' HA ' ' A' ' 22' ' ' GLN . 51.7 Cg_exo -55.47 -179.35 0.07 OUTLIER 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.834 2.356 . . . . 0.0 113.057 -178.711 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.08 -45.22 3.48 Favored Glycine 0 N--CA 1.451 -0.33 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.563 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 1.4 t -116.54 140.81 37.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.723 0.297 . . . . 0.0 111.217 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.645 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 3.4 mttt -60.67 108.91 0.91 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.842 179.813 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -79.89 106.43 11.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.95 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 74.56 81.01 0.48 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.462 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -92.67 -33.5 14.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.054 0.454 . . . . 0.0 110.998 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 3.5 tp . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.199 -0.905 . . . . 0.0 111.115 179.942 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.266 0 N-CA-C 112.429 -0.268 . . . . 0.0 112.429 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -77.42 166.81 25.45 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.548 2.165 . . . . 0.0 112.407 -179.758 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 8.0 tp -98.1 2.35 48.56 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.881 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.4 ' O ' ' HD3' ' A' ' 6' ' ' PRO . . . -103.61 17.31 50.4 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.623 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 87.4 p -82.27 111.22 26.07 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 120.562 0.22 . . . . 0.0 110.94 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.537 ' HB3' ' HB3' ' A' ' 9' ' ' ALA . 25.5 Cg_exo -63.2 138.22 65.53 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.589 2.192 . . . . 0.0 112.297 -179.783 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.436 ' O ' ' HG3' ' A' ' 11' ' ' MET . 3.7 mm? -100.94 -71.3 0.71 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.876 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.805 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 5.0 t -88.01 -27.15 22.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.216 -179.878 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.537 ' HB3' ' HB3' ' A' ' 6' ' ' PRO . . . -59.39 -40.8 87.75 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 176.607 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.427 ' HB2' ' HB2' ' A' ' 6' ' ' PRO . 37.4 t -67.8 -34.6 77.09 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.555 177.071 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.805 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.7 mtm -64.37 -39.3 93.6 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.264 177.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.813 HD21 ' HB3' ' A' ' 24' ' ' LEU . 45.5 mt -52.3 -45.67 65.63 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.274 -179.883 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.15 -34.04 77.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.994 178.305 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 37.3 m -101.87 21.65 14.27 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.594 -178.875 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.574 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -138.0 116.1 9.58 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.159 179.848 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -55.25 168.38 1.4 Allowed 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.679 2.253 . . . . 0.0 112.258 179.794 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.88 -35.73 94.43 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.448 2.099 . . . . 0.0 112.454 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -70.0 -12.14 61.39 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.052 -179.769 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.574 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.4 OUTLIER -83.88 9.46 12.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.756 179.709 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.505 ' OE1' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -48.19 -62.88 1.26 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.347 -179.735 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.745 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -55.7 -23.37 28.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.703 -178.103 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.507 ' H ' ' HD3' ' A' ' 21' ' ' LYS . 15.8 tt0 -73.08 -79.15 0.08 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.894 0.378 . . . . 0.0 111.766 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.647 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.46 -95.9 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -176.602 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.813 ' HB3' HD21 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -59.77 -1.56 0.28 Allowed 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -175.428 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.587 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 65.08 -116.05 8.45 Favored Glycine 0 N--CA 1.445 -0.733 0 N-CA-C 108.548 -1.821 . . . . 0.0 108.548 -174.374 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.85 -68.51 0.57 Allowed 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 168.941 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.847 ' HB2' HD13 ' A' ' 55' ' ' LEU . 10.7 tpt180 -159.89 7.69 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 114.136 -1.393 . . . . 0.0 107.794 175.332 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.793 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -60.71 -71.98 0.12 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.236 -1.347 . . . . 0.0 113.93 -173.414 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.64 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -35.5 -48.12 1.24 Allowed Pre-proline 0 CA--C 1.541 0.603 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -175.926 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.61 ' CD ' ' HB2' ' A' ' 24' ' ' LEU . 20.9 Cg_endo -64.18 -39.11 32.39 Favored 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 122.201 1.934 . . . . 0.0 113.573 -178.027 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 1.02 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.14 -45.92 65.83 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.764 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.74 HG21 HD12 ' A' ' 43' ' ' ILE . 0.6 OUTLIER -74.24 -13.72 15.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.932 177.6 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.562 ' HB3' ' O ' ' A' ' 30' ' ' PRO . 1.4 tt0 -62.27 -38.19 88.37 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 177.821 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.04 -31.0 68.41 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 175.153 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.517 ' HE1' ' HA ' ' A' ' 66' ' ' ARG . 4.8 mtt -100.34 27.15 5.91 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.026 177.886 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.808 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 8.5 p-80 -66.32 -30.84 3.83 Favored Pre-proline 0 CA--C 1.536 0.439 0 N-CA-C 113.719 1.007 . . . . 0.0 113.719 -176.438 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.808 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 4.1 Cg_exo -39.19 -28.93 0.18 Allowed 'Trans proline' 0 C--N 1.361 1.203 0 C-N-CA 122.271 1.981 . . . . 0.0 112.098 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.845 HG21 HG13 ' A' ' 73' ' ' VAL . 32.9 m -78.43 -83.85 0.08 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.393 177.637 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.48 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.2 OUTLIER -171.09 48.21 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.369 179.277 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.435 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -37.41 -37.85 0.21 Allowed 'General case' 0 N--CA 1.469 0.477 0 O-C-N 123.307 0.379 . . . . 0.0 111.975 -179.406 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.64 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.2 -59.76 6.13 Favored Glycine 0 C--N 1.33 0.235 0 CA-C-N 116.139 -0.482 . . . . 0.0 113.815 -179.259 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.889 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -77.49 -30.99 53.35 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.106 0.409 . . . . 0.0 112.106 -177.587 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.74 HD12 HG21 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -54.09 -56.24 10.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.113 -179.249 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.793 ' HA ' HD22 ' A' ' 28' ' ' LEU . 9.1 t -47.89 -49.34 30.04 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.083 -179.381 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.572 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -49.56 -61.94 5.19 Favored Glycine 0 CA--C 1.521 0.423 0 C-N-CA 121.153 -0.546 . . . . 0.0 113.595 -179.375 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.599 ' SD ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.2 -62.87 1.38 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.815 0.307 . . . . 0.0 111.827 -177.79 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.701 ' HB2' HD21 ' A' ' 28' ' ' LEU . 1.6 mm? -70.17 1.74 4.43 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 -177.785 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.591 ' HA ' HD13 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -66.52 -8.76 28.78 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.942 -0.303 . . . . 0.0 111.161 179.924 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.491 ' HG3' ' O ' ' B' ' 9' ' ' ASN . 2.7 mm-40 -74.65 16.14 0.3 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.414 0.626 . . . . 0.0 109.531 176.755 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.751 HD11 ' NZ ' ' A' ' 68' ' ' LYS . 0.2 OUTLIER -82.41 162.94 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.558 -179.833 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.505 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 3.5 m-20 -70.7 160.8 31.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.9 0.381 . . . . 0.0 111.873 -178.728 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.865 ' HA ' HD23 ' A' ' 55' ' ' LEU . 12.1 m-80 -89.12 -29.35 19.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.689 177.272 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -73.9 -30.72 62.76 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 176.768 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.505 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.1 OUTLIER -78.22 -28.87 48.04 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.675 178.981 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.865 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.9 OUTLIER -58.69 -44.84 90.41 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 179.428 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.639 ' HA ' HD11 ' A' ' 59' ' ' LEU . 8.0 tt -57.74 -49.18 77.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.37 177.779 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -57.06 -22.64 40.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.685 -179.682 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.689 ' HB3' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -71.27 -53.67 13.52 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -178.754 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.865 ' H ' HD13 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -68.11 -7.39 29.25 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 119.997 -0.681 . . . . 0.0 110.691 179.891 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.472 ' HG3' ' O ' ' A' ' 56' ' ' LEU . 4.9 mt-10 -99.46 -11.38 21.15 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.926 176.237 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.546 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 3.4 m -122.32 85.56 47.43 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.184 -179.026 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -62.51 -33.4 78.77 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.186 1.924 . . . . 0.0 111.65 178.586 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -78.44 -47.02 18.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.485 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.499 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 1.9 m -71.37 -54.9 9.19 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.917 0.389 . . . . 0.0 111.58 -178.304 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 1.02 HD21 HD13 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -58.21 -62.16 2.03 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.707 -177.805 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.688 ' N ' HD13 ' A' ' 65' ' ' LEU . 1.5 ttm180 -50.47 -37.16 36.94 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.746 -0.381 . . . . 0.0 111.345 -177.374 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.61 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 1.4 t -69.47 -34.53 74.5 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.312 0.577 . . . . 0.0 110.172 178.144 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.751 ' NZ ' HD11 ' A' ' 50' ' ' ILE . 3.0 ttpp -65.91 -57.23 8.33 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.161 178.716 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.528 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 37.1 t -64.93 -18.89 24.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.25 178.457 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.61 ' HB3' ' O ' ' A' ' 67' ' ' SER . 25.6 t70 -54.29 -48.72 70.96 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 176.727 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.435 ' HB3' HD13 ' B' ' 6' ' ' LEU . 18.5 tt0 -66.08 -35.17 79.79 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.682 176.813 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.643 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -55.33 -40.74 71.57 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.35 178.044 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.845 HG13 HG21 ' A' ' 38' ' ' THR . 9.9 t -60.7 -34.21 57.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.026 177.516 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.38 -35.09 65.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.696 -179.543 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.518 HG22 ' O ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -57.35 -29.68 33.68 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-O 121.019 0.438 . . . . 0.0 109.899 179.53 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.889 HD11 ' HB3' ' A' ' 42' ' ' LYS . 3.7 mm? -71.93 -54.95 8.43 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.772 178.11 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -50.91 -33.81 25.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.252 179.65 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.414 ' HA ' ' HB2' ' A' ' 82' ' ' LYS . . . -81.54 -32.59 32.18 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.662 177.794 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -61.58 -31.85 71.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.077 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.44 -63.95 1.25 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.78 -179.652 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.63 -57.88 3.46 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -176.701 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.414 ' HB2' ' HA ' ' A' ' 78' ' ' ALA . 11.1 mmtt -59.03 -20.22 51.08 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 -176.913 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -94.98 -38.16 10.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.687 0.28 . . . . 0.0 111.132 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -72.8 -20.27 61.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.114 -179.746 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -74.57 -70.63 0.39 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.975 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -90.49 89.64 7.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.719 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.41 ' H ' ' HG3' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -88.65 -80.12 0.29 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.797 179.836 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -86.68 -3.58 59.06 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.834 179.482 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.8 t -89.21 -13.12 9.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.934 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -79.44 72.97 6.1 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.914 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.5 p -98.56 33.42 2.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.805 179.882 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -74.73 178.85 5.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.997 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 3.3 p -112.26 154.37 25.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.971 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -85.93 156.7 30.19 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.76 -0.734 . . . . 0.0 112.443 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -108.0 97.73 22.7 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 120.751 0.31 . . . . 0.0 111.205 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.1 -23.68 24.53 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.524 2.149 . . . . 0.0 112.358 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -82.85 129.32 34.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.973 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.2 m . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.964 179.788 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 2.5 m . . . . . 0 N--CA 1.485 1.302 0 CA-C-O 120.839 0.352 . . . . 0.0 111.123 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 3.4 t -99.46 73.29 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.911 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 4.6 mmmt -87.14 22.83 1.96 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.937 -179.817 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 4' ' ' SER . . . . . 0.551 ' HB3' ' HB2' ' B' ' 10' ' ' ALA . 0.3 OUTLIER -93.02 164.55 13.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.883 179.959 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -120.45 -59.52 1.76 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.977 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.487 HD21 ' HG2' ' A' ' 68' ' ' LYS . 7.2 tp -69.58 -72.76 0.18 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.09 -179.769 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 7' ' ' ASN . . . . . 0.534 ' HB2' HD12 ' A' ' 47' ' ' LEU . 1.5 t-20 -88.95 130.24 45.39 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.985 179.668 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 3.4 Cg_exo -76.66 -0.76 10.82 Favored 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 122.476 2.117 . . . . 0.0 112.007 179.347 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 9' ' ' ASN . . . . . 0.491 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 68.9 m-20 -123.23 48.06 1.89 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.005 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 10' ' ' ALA . . . . . 0.579 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.37 99.15 0.07 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.812 -179.746 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.473 ' O ' ' HA ' ' A' ' 46' ' ' MET . 0.0 OUTLIER -122.37 153.58 38.83 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.679 178.407 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 12' ' ' GLU . . . . . 0.576 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 5.7 tt0 -55.4 169.85 0.27 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.916 0.388 . . . . 0.0 111.511 -179.464 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 13' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -88.34 112.99 23.49 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.581 179.554 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -113.41 86.96 10.67 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.541 179.226 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 15' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_endo -55.57 -172.22 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.746 2.298 . . . . 0.0 112.778 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.96 -51.1 4.51 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.271 -179.385 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -115.57 147.99 18.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.744 0.307 . . . . 0.0 110.967 179.5 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.745 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -68.56 88.37 0.34 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.716 179.637 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.413 ' HE2' ' HB2' ' B' ' 11' ' ' LYS . 0.3 OUTLIER -67.07 115.3 6.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.984 -179.606 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 93.65 35.0 6.32 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.549 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -99.61 15.22 27.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.886 0.374 . . . . 0.0 110.924 179.764 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.959 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.193 0 N-CA-C 112.533 -0.227 . . . . 0.0 112.533 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -61.41 107.21 0.47 Allowed 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.581 2.187 . . . . 0.0 112.247 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.08 98.02 7.08 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.934 -179.886 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -91.54 53.93 3.08 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.52 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.41 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 0.1 OUTLIER -85.29 152.99 58.95 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 120.368 0.128 . . . . 0.0 110.797 179.922 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.595 ' HD2' ' HB2' ' A' ' 10' ' ' SER . 12.8 Cg_exo -70.49 -172.09 7.67 Favored 'Cis proline' 0 C--N 1.35 0.638 0 C-N-CA 123.916 -1.285 . . . . 0.0 112.586 -0.038 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.472 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.2 OUTLIER -88.93 -74.28 0.47 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.311 -179.546 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.737 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 8.9 t -87.8 -33.08 18.75 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.89 -178.703 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.5 ' HB3' ' HB2' ' A' ' 6' ' ' PRO . . . -59.09 -37.11 76.36 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 177.381 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.595 ' HB2' ' HD2' ' A' ' 6' ' ' PRO . 13.4 t -70.45 -34.01 71.96 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.884 177.559 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.737 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 11.8 mtm -64.29 -36.41 84.02 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 177.63 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.598 HD11 ' HB3' ' A' ' 24' ' ' LEU . 2.0 mp -52.12 -52.47 51.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.996 178.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.33 -28.7 68.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.233 178.478 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.2 p -101.4 17.73 21.92 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.953 -178.097 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.576 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -138.56 120.78 10.55 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.696 -0.229 . . . . 0.0 111.0 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.483 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 23.1 Cg_endo -60.13 169.69 4.66 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.415 2.077 . . . . 0.0 111.882 179.239 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -56.9 -32.13 91.38 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.362 2.042 . . . . 0.0 112.27 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.5 mt-30 -73.53 -9.84 59.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.107 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.576 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.5 OUTLIER -89.24 7.22 36.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.11 -179.536 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.466 ' HA ' HD11 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -46.52 -60.5 2.32 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.745 -177.812 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.618 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -56.05 -22.38 27.19 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.913 -177.617 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.618 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 5.9 tt0 -73.37 -78.76 0.09 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.013 0.435 . . . . 0.0 111.428 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.628 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.3 -97.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.68 -176.396 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.628 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -59.62 -2.19 0.33 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -175.714 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.443 ' HA3' HD11 ' A' ' 48' ' ' LEU . . . 65.21 -115.55 7.85 Favored Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 108.672 -1.771 . . . . 0.0 108.672 -174.426 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.499 ' O ' HD13 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -75.8 -69.65 0.48 Allowed 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 169.386 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.919 ' HG2' HD22 ' A' ' 59' ' ' LEU . 4.8 tpt180 -159.48 13.01 0.14 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.377 -1.283 . . . . 0.0 108.156 175.48 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.543 HD12 HD11 ' A' ' 32' ' ' ILE . 4.2 mm? -57.41 -83.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.56 -1.2 . . . . 0.0 113.809 -173.187 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.673 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -33.04 -51.47 0.66 Allowed Pre-proline 0 CA--C 1.536 0.404 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 -174.846 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.593 ' HG2' ' O ' ' A' ' 27' ' ' ARG . 10.5 Cg_endo -56.39 -42.0 70.42 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.394 2.062 . . . . 0.0 113.646 -177.692 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.86 ' HB3' HD11 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.84 -48.26 54.91 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 120.128 -0.629 . . . . 0.0 109.893 -179.665 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.543 HD11 HD12 ' A' ' 28' ' ' LEU . 0.5 OUTLIER -71.33 -14.1 17.51 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.626 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.037 178.424 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.651 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -62.19 -39.29 92.23 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.196 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.77 -29.87 69.94 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.257 -0.883 . . . . 0.0 108.964 174.479 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.534 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 7.7 mtt -101.99 26.14 7.91 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.349 178.184 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.651 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -64.33 -31.98 6.69 Favored Pre-proline 0 CA--C 1.535 0.392 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -177.897 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.592 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 51.0 Cg_exo -35.0 -34.36 0.1 OUTLIER 'Trans proline' 0 C--N 1.364 1.365 0 C-N-CA 122.16 1.907 . . . . 0.0 112.008 178.924 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.43 ' HB ' ' H ' ' A' ' 39' ' ' LEU . 20.5 m -78.19 -89.63 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 175.723 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.596 HD23 HD11 ' A' ' 76' ' ' LEU . 3.1 tp -171.93 67.63 0.04 OUTLIER 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.427 177.448 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.516 ' HB1' ' HB ' ' A' ' 32' ' ' ILE . . . -50.24 -24.5 2.92 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.804 0.335 . . . . 0.0 111.573 179.542 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.624 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -49.89 -62.98 4.53 Favored Glycine 0 CA--C 1.518 0.265 0 CA-C-N 115.965 -0.562 . . . . 0.0 114.298 -178.177 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.661 ' HB3' HD12 ' A' ' 76' ' ' LEU . 2.4 tptm -77.42 -32.79 54.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 117.169 0.484 . . . . 0.0 112.03 -177.328 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.653 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 18.7 mt -54.21 -55.95 12.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.729 -0.214 . . . . 0.0 111.427 -178.822 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.58 HG21 ' CD2' ' A' ' 29' ' ' PHE . 4.7 t -47.69 -46.86 29.82 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.887 0.375 . . . . 0.0 110.473 179.077 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.717 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -54.44 -61.95 6.7 Favored Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 115.73 -0.668 . . . . 0.0 113.551 -179.559 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.528 ' SD ' ' HG3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.73 -48.07 75.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.859 0.329 . . . . 0.0 111.414 -178.322 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.453 ' O ' ' HB ' ' A' ' 50' ' ' ILE . 3.2 mm? -80.1 2.43 24.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.439 -179.493 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.498 ' HG ' ' CD1' ' B' ' 13' ' ' PHE . 0.0 OUTLIER -65.93 -12.41 54.53 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.979 0.418 . . . . 0.0 110.392 179.333 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -78.95 17.85 0.69 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.277 177.828 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.453 ' HB ' ' O ' ' A' ' 47' ' ' LEU . 0.6 OUTLIER -83.58 162.74 3.07 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.876 -179.53 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.438 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 1.8 m-20 -70.76 158.84 35.6 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.769 -178.854 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.897 ' HA ' HD23 ' A' ' 55' ' ' LEU . 15.5 m-80 -83.58 -28.28 28.65 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.788 177.178 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.645 ' HA ' HD21 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -74.51 -32.03 62.37 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.408 0.623 . . . . 0.0 109.902 177.419 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.438 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 1.0 OUTLIER -77.84 -26.61 49.53 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.483 178.92 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.897 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.5 OUTLIER -62.48 -49.66 74.53 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.654 179.984 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.692 ' HA ' HD21 ' A' ' 59' ' ' LEU . 0.4 OUTLIER -59.59 -40.98 89.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.985 -179.441 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 3.3 m-70 -63.06 -20.61 65.5 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.634 -179.406 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.533 ' HE2' ' HA ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -76.89 -60.0 2.54 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -178.77 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.919 HD22 ' HG2' ' A' ' 27' ' ' ARG . 2.5 pt? -66.69 -4.06 8.04 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.375 179.662 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.456 ' HB3' ' O ' ' A' ' 56' ' ' LEU . 1.3 tt0 -104.24 -19.12 14.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.894 177.663 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.446 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 0.5 OUTLIER -122.52 87.14 49.08 Favored Pre-proline 0 C--O 1.223 -0.334 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.134 179.398 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -54.3 -34.11 78.74 Favored 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.469 2.113 . . . . 0.0 112.661 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.634 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.0 -48.7 15.59 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.617 -178.998 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.634 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 23.3 m -72.73 -26.68 61.67 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.176 0.512 . . . . 0.0 111.098 -179.193 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.86 HD11 ' HB3' ' A' ' 31' ' ' LEU . 0.2 OUTLIER -77.8 -65.79 0.92 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.155 -178.6 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.461 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.3 OUTLIER -49.75 -28.39 6.11 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.807 -177.854 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.462 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.5 OUTLIER -68.64 -39.56 80.68 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.25 178.348 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.491 ' HE2' ' HE2' ' A' ' 58' ' ' MET . 0.2 OUTLIER -65.03 -59.91 3.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.211 178.918 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.514 ' CG1' HG23 ' A' ' 32' ' ' ILE . 54.4 t -63.15 -20.51 26.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.007 -179.426 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.622 ' O ' HG22 ' A' ' 73' ' ' VAL . 23.8 t70 -55.07 -49.72 70.94 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 176.726 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.586 ' HG2' ' HB3' ' B' ' 5' ' ' ASN . 49.1 tt0 -68.97 -26.67 65.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.801 176.834 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.653 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -62.63 -51.84 65.69 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.367 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.622 HG22 ' O ' ' A' ' 70' ' ' ASP . 5.3 m -56.73 -28.43 27.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.161 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 177.891 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.538 ' O ' ' HG3' ' A' ' 77' ' ' GLN . . . -72.59 -30.62 64.53 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.342 179.33 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.801 HG12 ' HB2' ' B' ' 5' ' ' ASN . 1.0 OUTLIER -67.44 -37.41 78.86 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.189 0 CA-C-O 120.791 0.329 . . . . 0.0 110.532 179.617 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.661 HD12 ' HB3' ' A' ' 42' ' ' LYS . 0.3 OUTLIER -71.87 -52.7 16.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.945 179.548 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.538 ' HG3' ' O ' ' A' ' 74' ' ' ALA . 1.5 pp0? -56.05 -35.18 66.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.121 0.486 . . . . 0.0 109.997 179.556 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.91 -21.09 40.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.613 178.004 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.559 ' O ' ' HB3' ' A' ' 83' ' ' GLU . 11.3 t-160 -68.13 -30.01 69.05 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.718 179.452 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -77.73 6.07 8.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.121 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -80.24 -75.33 0.27 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.863 0.364 . . . . 0.0 111.631 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 5.2 mtmt -79.9 -23.4 41.84 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.792 -178.197 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.559 ' HB3' ' O ' ' A' ' 79' ' ' HIS . 1.0 OUTLIER -74.48 -34.65 63.15 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.77 0.319 . . . . 0.0 111.086 -179.185 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -75.07 3.62 8.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.418 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -70.63 -6.45 36.95 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.928 0.394 . . . . 0.0 111.008 179.669 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -92.34 -50.71 5.51 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.686 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.738 ' HB3' HG23 ' A' ' 89' ' ' VAL . 0.0 OUTLIER -79.85 156.33 27.41 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.894 179.998 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -89.52 22.47 2.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.065 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.738 HG23 ' HB3' ' A' ' 87' ' ' LYS . 1.4 t -91.81 17.23 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.901 179.879 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -94.58 123.73 38.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.973 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 87.4 p -87.52 162.6 17.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.846 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -88.6 95.57 10.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.059 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 33.9 p -95.7 85.92 4.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.91 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -94.58 -174.7 38.52 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.522 -179.707 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 26.5 t -87.53 113.86 56.14 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-O 120.557 0.218 . . . . 0.0 111.048 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -55.27 152.61 30.84 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.613 2.208 . . . . 0.0 112.335 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -84.17 -12.16 55.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.024 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 14.6 p . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.052 -0.975 . . . . 0.0 111.11 -179.754 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 6.2 m . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.773 0.32 . . . . 0.0 111.013 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -97.03 97.48 6.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.913 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 4.7 mtmm -85.34 81.53 8.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.903 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.01 -173.32 3.83 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.858 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 5' ' ' ASN . . . . . 0.801 ' HB2' HG12 ' A' ' 75' ' ' VAL . 2.0 m-20 -104.03 -78.13 0.56 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.929 -179.917 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' B' ' 6' ' ' LEU . 1.9 mt -67.52 -82.85 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.795 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -74.66 124.18 89.53 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.917 179.758 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.26 1.98 7.73 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.18 1.92 . . . . 0.0 111.791 178.811 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 9' ' ' ASN . . . . . 0.69 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 22.8 m120 -123.23 48.54 1.81 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.7 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.33 98.5 0.06 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.708 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.69 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 19.9 mmtp -122.88 153.09 40.1 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.323 178.204 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -55.26 165.0 0.81 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.863 0.363 . . . . 0.0 111.12 -179.682 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 13' ' ' PHE . . . . . 0.717 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.2 t80 -88.38 68.6 8.91 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.741 -179.538 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 14' ' ' VAL . . . . . 0.606 ' N ' ' CD ' ' B' ' 15' ' ' PRO . 5.9 m -131.57 26.27 0.12 Allowed Pre-proline 0 CA--C 1.539 0.536 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 15' ' ' PRO . . . . . 0.75 ' HG3' ' HB2' ' B' ' 19' ' ' TYR . 31.6 Cg_endo -57.74 -30.69 89.97 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 122.074 1.849 . . . . 0.0 112.689 179.271 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.41 -48.61 4.08 Favored Glycine 0 N--CA 1.449 -0.459 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 -176.001 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 22.7 m -115.75 -161.52 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 177.047 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.507 ' HB2' ' OD1' ' B' ' 21' ' ' ASN . 0.1 OUTLIER -61.47 113.53 2.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.693 0.282 . . . . 0.0 110.862 179.409 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.75 ' HB2' ' HG3' ' B' ' 15' ' ' PRO . 0.3 OUTLIER -85.3 104.93 15.59 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.013 -179.957 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 91.3 75.56 1.31 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.461 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 21' ' ' ASN . . . . . 0.507 ' OD1' ' HB2' ' B' ' 18' ' ' LYS . 19.2 m120 -94.02 -19.97 20.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.798 0.332 . . . . 0.0 110.984 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 3.2 pt . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.289 -0.862 . . . . 0.0 111.053 -179.862 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.232 0 N-CA-C 112.456 -0.258 . . . . 0.0 112.456 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_exo -57.06 137.9 83.93 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.654 2.236 . . . . 0.0 112.246 179.953 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.41 179.23 7.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.905 179.875 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.94 70.67 2.49 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.625 -179.965 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.614 ' H ' ' HD2' ' A' ' 6' ' ' PRO . 0.1 OUTLIER -93.05 -50.94 0.27 Allowed Pre-proline 0 CA--C 1.534 0.338 0 N-CA-C 111.486 0.18 . . . . 0.0 111.486 -179.973 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.614 ' HD2' ' H ' ' A' ' 5' ' ' SER . 33.4 Cg_endo -63.92 128.39 21.82 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 122.141 1.894 . . . . 0.0 112.25 179.992 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.459 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.1 OUTLIER -100.89 -63.78 1.1 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.239 -179.574 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.756 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 6.9 t -87.93 -33.3 18.52 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.647 -178.992 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.448 ' HB2' ' OE1' ' A' ' 33' ' ' GLN . . . -59.41 -35.63 74.34 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 177.341 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 5.5 t -71.23 -34.69 71.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.737 177.365 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.756 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.0 mtm -64.23 -36.25 83.48 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.85 177.692 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.713 HD11 ' HB3' ' A' ' 24' ' ' LEU . 1.9 mp -52.41 -53.53 43.91 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.895 178.768 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.42 -26.74 67.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.976 178.268 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.4 22.84 11.92 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.778 -178.654 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.76 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -134.23 59.97 40.98 Favored Pre-proline 0 CA--C 1.533 0.312 0 CA-C-O 120.611 0.243 . . . . 0.0 111.065 179.81 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.491 ' HD3' ' N ' ' A' ' 15' ' ' ALA . 51.7 Cg_exo -57.78 -51.24 8.45 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 122.797 2.331 . . . . 0.0 113.946 -178.165 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.416 ' HD2' ' N ' ' A' ' 16' ' ' PRO . 57.9 Cg_endo -70.18 -159.2 0.06 OUTLIER 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 121.901 1.734 . . . . 0.0 112.705 -178.683 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -73.62 68.6 1.21 Allowed 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.748 179.481 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.76 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.9 OUTLIER -104.42 15.73 27.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.608 179.883 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.414 ' NE2' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -53.11 -63.25 1.21 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.637 -179.565 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.466 ' H ' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -56.17 -21.35 22.35 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.2 -179.087 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.467 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 2.1 tp-100 -73.55 -81.04 0.07 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.973 0.416 . . . . 0.0 111.667 179.571 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.574 ' SD ' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.67 -97.11 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -176.272 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.713 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -56.93 0.71 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -175.183 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.604 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 65.12 -117.51 10.44 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 108.481 -1.848 . . . . 0.0 108.481 -174.783 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.432 ' HG3' ' HA ' ' A' ' 52' ' ' ASN . 0.3 OUTLIER -75.54 -68.03 0.61 Allowed 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 168.715 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.757 ' HB2' HD13 ' A' ' 55' ' ' LEU . 1.0 OUTLIER -160.51 7.69 0.09 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.121 -1.4 . . . . 0.0 107.914 174.784 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.98 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.73 -73.21 0.09 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.387 -1.279 . . . . 0.0 114.139 -173.064 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.649 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -36.46 -49.23 1.81 Allowed Pre-proline 0 CA--C 1.536 0.426 0 N-CA-C 113.612 0.968 . . . . 0.0 113.612 -175.789 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.6 ' HG3' ' HB2' ' A' ' 24' ' ' LEU . 18.9 Cg_endo -61.76 -39.33 53.56 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 122.19 1.926 . . . . 0.0 113.593 -177.41 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.727 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.15 -46.95 60.49 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 120.26 -0.576 . . . . 0.0 110.087 -179.496 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.596 HD11 HD23 ' A' ' 28' ' ' LEU . 0.7 OUTLIER -72.31 -17.71 18.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.294 -0.412 . . . . 0.0 109.925 177.71 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.636 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 1.0 OUTLIER -63.36 -31.98 73.28 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 176.286 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.25 -27.77 61.76 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 175.011 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.451 ' HE1' ' HB ' ' A' ' 69' ' ' VAL . 12.2 mtt -99.97 16.82 22.67 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 114.862 -1.063 . . . . 0.0 109.655 177.17 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.81 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 0.4 OUTLIER -63.45 -34.81 13.95 Favored Pre-proline 0 CA--C 1.534 0.345 0 CA-C-N 115.379 -0.828 . . . . 0.0 112.011 -179.235 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.81 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 2.2 Cg_endo -39.87 -30.05 0.35 Allowed 'Trans proline' 0 C--N 1.364 1.369 0 C-N-CA 122.106 1.871 . . . . 0.0 110.713 177.386 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.639 HG21 ' CG1' ' A' ' 73' ' ' VAL . 0.2 OUTLIER -78.18 -84.38 0.08 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.209 175.161 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.716 HD23 HD11 ' A' ' 76' ' ' LEU . 11.7 tp -172.15 63.41 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 177.603 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.34 -176.02 0.06 Allowed 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 175.736 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.649 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . 103.91 -69.21 0.28 Allowed Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.292 -0.956 . . . . 0.0 113.112 179.664 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.693 ' HE2' ' HG2' ' A' ' 46' ' ' MET . 1.0 OUTLIER -77.25 -34.97 55.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.825 0.345 . . . . 0.0 111.04 -179.655 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.698 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 17.6 mt -54.08 -53.03 31.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.108 -179.39 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.98 ' HA ' HD22 ' A' ' 28' ' ' LEU . 8.9 t -54.65 -43.75 72.63 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-O 120.9 0.381 . . . . 0.0 110.313 178.22 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.788 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -48.11 -61.27 5.02 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.573 -0.74 . . . . 0.0 113.457 -178.769 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.792 ' CE ' HG21 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -61.8 -50.08 73.78 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -177.757 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.751 HD13 ' HB2' ' B' ' 7' ' ' ASN . 4.0 mm? -78.75 11.05 2.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.602 0.239 . . . . 0.0 111.493 -179.018 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.632 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -63.79 -29.44 70.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.295 -179.186 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.32 29.02 0.15 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.772 0.32 . . . . 0.0 110.921 179.094 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.549 HD11 ' HZ2' ' A' ' 68' ' ' LYS . 2.5 tt -82.77 169.78 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.365 179.081 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.567 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 16.8 m-20 -67.54 137.59 55.86 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.537 -179.0 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.838 ' HA ' HD23 ' A' ' 55' ' ' LEU . 15.1 m-80 -76.51 -27.71 56.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.171 0.51 . . . . 0.0 109.642 177.198 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 42.6 m -74.05 -31.27 62.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.639 177.437 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.567 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 2.2 mm-40 -77.51 -29.89 52.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.668 178.925 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.838 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -58.85 -46.73 87.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.284 -179.953 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.461 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 33.1 tp -61.64 -43.6 98.55 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.409 178.843 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 28.8 m80 -66.93 -19.41 65.72 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.982 179.79 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.514 ' SD ' ' HA ' ' A' ' 65' ' ' LEU . 17.9 mmt -72.4 -47.51 48.65 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.988 -179.983 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.595 HD23 ' CG ' ' A' ' 27' ' ' ARG . 0.2 OUTLIER -66.33 -20.91 66.22 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.229 -179.831 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -96.54 -7.54 34.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.716 0.293 . . . . 0.0 111.576 -179.316 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.627 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -122.88 88.39 50.51 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.891 -179.951 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -62.63 -32.1 79.24 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.302 2.001 . . . . 0.0 112.052 179.552 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.401 ' O ' ' HB2' ' A' ' 67' ' ' SER . 7.6 mt-10 -78.06 -48.84 15.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.498 -179.776 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 26.1 m -69.49 -48.8 59.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.394 -178.376 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.627 ' HB3' ' O ' ' A' ' 61' ' ' SER . 0.9 OUTLIER -59.75 -64.83 0.81 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.874 -178.662 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.615 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.5 OUTLIER -50.1 -29.38 8.88 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.068 -177.215 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.401 ' HB2' ' O ' ' A' ' 63' ' ' GLU . 0.6 OUTLIER -63.75 -43.96 94.91 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.078 0.466 . . . . 0.0 110.229 178.134 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.722 ' HG2' HD11 ' B' ' 6' ' ' LEU . 25.6 mtpt -66.16 -60.68 2.57 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.937 179.327 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.505 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 75.6 t -61.13 -23.18 29.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.194 -178.542 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.45 ' HB2' ' O ' ' A' ' 66' ' ' ARG . 24.8 t70 -55.58 -49.95 71.37 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 176.612 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.665 ' HG2' ' HB3' ' B' ' 5' ' ' ASN . 0.5 OUTLIER -68.9 -28.16 66.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.69 176.542 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.698 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -59.83 -37.66 79.84 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.068 177.933 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.639 ' CG1' HG21 ' A' ' 38' ' ' THR . 28.4 t -66.43 -29.63 47.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 176.975 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.413 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -71.11 -40.39 71.51 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.292 179.46 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.792 HG21 ' CE ' ' A' ' 46' ' ' MET . 0.9 OUTLIER -54.55 -39.33 45.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-O 120.96 0.41 . . . . 0.0 110.222 179.385 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.716 HD11 HD23 ' A' ' 39' ' ' LEU . 1.2 tt -64.28 -46.45 83.64 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.747 -178.751 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 8.7 mm100 -53.86 -35.85 61.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.263 179.428 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.25 -26.91 35.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.469 177.904 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.485 ' O ' ' HB3' ' A' ' 83' ' ' GLU . 3.4 t-80 -77.39 -12.04 59.91 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.847 179.724 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -83.38 -35.76 24.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.549 179.427 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.63 -50.29 10.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.508 -179.275 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 3.8 mmtm -61.2 -38.84 88.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.556 -178.666 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.485 ' HB3' ' O ' ' A' ' 79' ' ' HIS . 17.3 tt0 -74.69 -50.94 15.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.322 -178.77 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.84 -26.11 68.47 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.531 -179.289 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.65 -74.04 0.11 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.203 -179.523 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -88.36 103.89 16.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.95 -179.705 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 24.2 mttt -93.82 39.38 1.07 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.7 179.919 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -85.92 -0.22 54.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.096 -179.749 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.13 -37.94 6.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.99 179.872 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -90.99 167.62 12.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.918 179.85 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -74.66 105.85 5.94 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.009 -179.91 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.12 -174.63 2.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.029 179.994 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 33.1 p -112.09 170.71 7.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.928 -179.997 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -88.31 -41.63 6.11 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.49 -179.923 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.431 HG12 ' HD2' ' A' ' 96' ' ' PRO . 0.2 OUTLIER -97.26 135.44 21.86 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.518 0.199 . . . . 0.0 110.954 179.997 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.431 ' HD2' HG12 ' A' ' 95' ' ' VAL . 18.8 Cg_endo -58.43 -37.01 96.82 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.506 2.137 . . . . 0.0 112.126 179.75 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 9.9 t -103.31 155.11 18.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.571 179.336 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.995 0 CA-C-O 117.984 -1.008 . . . . 0.0 111.112 -179.649 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 14.8 p . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.761 0.315 . . . . 0.0 111.033 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 1.9 t -89.54 119.4 36.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.03 179.904 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 59.4 mmtt -76.9 100.68 5.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.12 -179.685 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 4' ' ' SER . . . . . 0.403 ' HB3' ' O ' ' B' ' 7' ' ' ASN . 3.3 t -93.48 -165.97 1.43 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.866 179.648 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 5' ' ' ASN . . . . . 0.67 ' HB2' HG12 ' A' ' 75' ' ' VAL . 2.8 m120 -105.49 -59.46 1.76 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.874 179.775 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.748 ' HB3' HD11 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -74.15 -87.87 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.408 179.349 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 7' ' ' ASN . . . . . 0.751 ' HB2' HD13 ' A' ' 47' ' ' LEU . 1.7 t-20 -74.41 131.5 80.23 Favored Pre-proline 0 C--N 1.332 -0.176 0 CA-C-N 116.616 -0.265 . . . . 0.0 110.546 178.714 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -75.24 -3.91 14.59 Favored 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.109 1.872 . . . . 0.0 112.096 179.262 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 71.8 m-80 -123.35 49.8 1.65 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.657 179.543 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 10' ' ' ALA . . . . . 0.704 ' HB1' ' HB2' ' A' ' 46' ' ' MET . . . -54.17 95.0 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.714 -179.283 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.645 ' C ' ' HA ' ' A' ' 46' ' ' MET . 6.0 mttp -109.57 124.26 50.82 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.704 179.288 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 12' ' ' GLU . . . . . 0.674 ' HG2' ' HE3' ' A' ' 42' ' ' LYS . 51.6 mt-10 -47.48 173.01 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -177.895 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 13' ' ' PHE . . . . . 0.788 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.4 OUTLIER -87.41 77.78 8.81 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.352 -179.929 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 14' ' ' VAL . . . . . 0.593 ' H ' ' CD ' ' B' ' 15' ' ' PRO . 3.5 m -116.16 -31.78 0.09 OUTLIER Pre-proline 0 CA--C 1.54 0.571 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 -177.359 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 15' ' ' PRO . . . . . 0.593 ' CD ' ' H ' ' B' ' 14' ' ' VAL . 50.3 Cg_exo -54.7 -40.67 83.42 Favored 'Trans proline' 0 C--N 1.357 1.006 0 C-N-CA 121.693 1.595 . . . . 0.0 112.378 -179.197 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 83.73 -31.91 3.25 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.375 -179.694 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 34.9 m -94.91 -172.44 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.713 0.292 . . . . 0.0 110.781 179.643 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.86 91.95 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.907 0.384 . . . . 0.0 110.735 179.937 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.488 ' CG ' ' HG2' ' B' ' 15' ' ' PRO . 1.7 t80 -82.79 103.01 11.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.055 -179.35 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 93.51 76.18 1.32 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.558 -179.948 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 10.3 p-10 -100.26 -14.67 18.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.792 0.33 . . . . 0.0 110.909 179.911 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 6.0 tt . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.279 -0.867 . . . . 0.0 111.024 -179.982 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.116 0 CA-C-O 120.185 -0.23 . . . . 0.0 112.529 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.457 ' HG2' HD22 ' A' ' 3' ' ' LEU . 61.1 Cg_endo -73.15 -3.76 14.22 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.544 2.163 . . . . 0.0 112.347 -179.913 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.457 HD22 ' HG2' ' A' ' 2' ' ' PRO . 3.7 mm? -98.28 51.35 1.01 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.861 -179.994 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -84.04 58.79 5.0 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.577 -179.759 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -92.29 -50.76 0.29 Allowed Pre-proline 0 CA--C 1.533 0.325 0 N-CA-C 111.373 0.138 . . . . 0.0 111.373 179.873 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -63.04 -8.25 13.58 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 122.249 1.966 . . . . 0.0 112.393 -179.812 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.46 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.5 OUTLIER -81.78 45.1 0.87 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.06 -179.858 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.835 HG21 ' HB3' ' A' ' 29' ' ' PHE . 1.8 t -87.95 -33.04 18.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.469 -179.693 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.408 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.26 -37.06 76.67 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 177.237 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.4 t -69.08 -35.54 76.61 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.659 177.014 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.722 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.2 mtm -64.17 -36.47 84.16 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.886 177.669 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.755 HD11 ' HB3' ' A' ' 24' ' ' LEU . 2.4 mp -52.27 -48.94 65.0 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.156 179.356 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.02 -31.09 71.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.129 178.903 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 56.8 m -101.44 15.47 28.73 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.757 -178.882 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.591 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -136.44 123.14 14.02 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.031 179.967 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -62.58 168.69 9.51 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.521 2.147 . . . . 0.0 111.826 179.356 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -52.76 -43.36 56.44 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.404 2.07 . . . . 0.0 112.366 179.984 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.13 -16.22 51.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.547 -179.549 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.691 ' HG3' ' HB3' ' A' ' 22' ' ' GLN . 4.6 tp10 -86.22 12.35 10.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.081 -179.478 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.436 ' O ' HD23 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -52.83 -60.08 3.7 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.345 -179.868 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.526 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.86 -20.54 15.91 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.496 -178.171 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.691 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 2.7 tp60 -73.2 -79.98 0.07 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.908 0.385 . . . . 0.0 111.425 179.317 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.671 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.55 -94.39 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.687 -176.979 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.755 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -62.11 -1.56 0.73 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -175.291 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.55 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.87 -116.71 9.27 Favored Glycine 0 N--CA 1.444 -0.794 0 N-CA-C 108.427 -1.869 . . . . 0.0 108.427 -174.268 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.424 ' O ' HD13 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -76.63 -69.63 0.5 Allowed 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 169.43 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.914 ' HG2' HD22 ' A' ' 59' ' ' LEU . 1.3 tpt180 -159.86 12.46 0.13 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.318 -1.31 . . . . 0.0 107.985 176.09 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.565 HD12 HD11 ' A' ' 32' ' ' ILE . 3.6 mm? -57.54 -76.06 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.488 -1.233 . . . . 0.0 113.606 -173.243 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.835 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -41.0 -46.65 6.97 Favored Pre-proline 0 C--N 1.325 -0.495 0 N-CA-C 113.728 1.01 . . . . 0.0 113.728 -174.653 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.602 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 50.4 Cg_exo -57.53 -43.83 47.55 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.236 1.957 . . . . 0.0 113.818 -178.216 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.851 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.7 -48.83 52.62 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.228 -178.066 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.84 HG21 HD12 ' A' ' 43' ' ' ILE . 0.9 OUTLIER -73.43 -14.52 16.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.522 179.15 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.626 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.7 OUTLIER -60.88 -42.33 97.76 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 177.03 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.65 -30.02 70.66 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.143 174.902 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.507 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 6.3 mtt -101.41 26.79 6.84 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.657 178.576 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.626 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.4 p-80 -66.04 -32.37 5.61 Favored Pre-proline 0 CA--C 1.537 0.46 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -177.457 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.615 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 44.0 Cg_exo -34.11 -35.9 0.09 OUTLIER 'Trans proline' 0 C--N 1.363 1.318 0 C-N-CA 122.383 2.055 . . . . 0.0 112.466 179.457 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.448 ' HB ' ' H ' ' A' ' 39' ' ' LEU . 1.8 m -78.76 -84.13 0.08 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.816 176.891 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.812 ' HB3' HD22 ' A' ' 76' ' ' LEU . 0.6 OUTLIER -171.36 63.54 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.396 178.212 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.563 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -50.09 -38.29 37.86 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.888 0.375 . . . . 0.0 111.398 179.516 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.582 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -47.94 -47.94 25.24 Favored Glycine 0 CA--C 1.517 0.197 0 CA-C-N 115.782 -0.645 . . . . 0.0 114.13 -178.227 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.616 ' HE3' ' HG3' ' B' ' 12' ' ' GLU . 2.2 tptm -77.74 -42.59 33.66 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -177.192 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.921 HG21 ' HB1' ' A' ' 72' ' ' ALA . 20.3 mt -53.51 -56.51 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 C-N-CA 120.761 -0.376 . . . . 0.0 111.288 -178.267 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.573 HG21 ' CD2' ' A' ' 29' ' ' PHE . 9.8 t -47.04 -46.92 22.49 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 179.234 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.921 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -51.57 -67.51 1.96 Allowed Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 115.33 -0.85 . . . . 0.0 113.212 179.352 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.618 ' HA ' ' C ' ' B' ' 11' ' ' LYS . 0.0 OUTLIER -55.57 -57.75 10.65 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -177.246 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.814 HD23 ' HB2' ' B' ' 7' ' ' ASN . 3.5 mp -79.39 14.52 1.54 Allowed 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -177.068 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.513 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.71 -10.51 47.48 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.235 0.54 . . . . 0.0 109.543 176.359 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.496 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 3.5 mt-10 -80.17 19.89 0.7 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.711 178.96 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.462 HG12 ' HG2' ' A' ' 54' ' ' GLU . 1.3 tt -83.31 162.64 3.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.021 -179.236 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.46 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 4.0 m-20 -70.66 156.78 39.03 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.946 0.403 . . . . 0.0 111.72 -178.449 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.943 ' HA ' HD23 ' A' ' 55' ' ' LEU . 21.2 m-80 -84.09 -30.11 26.26 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.21 178.312 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 8.4 t -73.9 -34.03 64.25 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.369 0.604 . . . . 0.0 109.53 177.342 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.462 ' HG2' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -75.84 -28.54 58.28 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.52 179.147 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.943 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -59.59 -46.54 88.63 Favored 'General case' 0 CA--C 1.522 -0.128 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.298 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.646 ' HA ' HD21 ' A' ' 59' ' ' LEU . 61.7 tp -57.83 -49.39 76.83 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.072 -179.678 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.469 ' O ' ' HB2' ' A' ' 61' ' ' SER . 19.3 m-70 -58.78 -21.61 56.33 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.806 -178.992 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.606 ' HE2' ' HA ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -76.17 -57.99 3.54 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -177.742 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.914 HD22 ' HG2' ' A' ' 27' ' ' ARG . 2.2 pt? -65.73 -6.86 12.88 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.538 -0.465 . . . . 0.0 111.098 -178.864 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -105.98 -9.43 17.07 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.94 0.4 . . . . 0.0 110.634 177.745 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.587 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -122.66 97.93 43.82 Favored Pre-proline 0 C--N 1.331 -0.199 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.099 179.61 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -64.94 -30.07 57.55 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.188 1.925 . . . . 0.0 111.924 179.114 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.451 ' O ' ' HB2' ' A' ' 67' ' ' SER . 3.2 mm-40 -78.31 -51.77 9.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.615 -179.75 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.416 ' HB3' ' HB3' ' A' ' 61' ' ' SER . 47.3 t -69.23 -40.29 78.01 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.887 -177.819 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.851 HD21 HD13 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -77.95 -65.14 1.01 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.177 -176.179 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.686 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -51.06 -33.7 26.83 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.885 -0.326 . . . . 0.0 111.524 -176.797 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.471 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 2.9 m -69.97 -35.84 74.75 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.001 0.429 . . . . 0.0 110.195 178.286 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.33 -52.34 48.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.304 178.717 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.615 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 55.4 t -70.37 -16.37 19.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.484 179.127 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.608 ' O ' HG22 ' A' ' 73' ' ' VAL . 20.1 t0 -58.56 -49.05 78.84 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 176.554 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.54 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 2.4 tp10 -68.7 -21.86 64.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.59 176.258 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.921 ' HB1' HG21 ' A' ' 43' ' ' ILE . . . -64.18 -45.38 88.66 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.633 179.353 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.608 HG22 ' O ' ' A' ' 70' ' ' ASP . 2.2 m -59.66 -29.77 43.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 176.852 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.54 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -67.76 -25.18 65.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.91 178.398 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.752 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.3 m -69.89 -32.72 52.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 178.723 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.812 HD22 ' HB3' ' A' ' 39' ' ' LEU . 8.0 mt -70.98 -57.67 4.32 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.956 179.09 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.529 ' HG3' ' O ' ' A' ' 74' ' ' ALA . 0.0 OUTLIER -51.27 -35.58 38.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.047 179.976 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.16 -26.49 36.01 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.791 177.775 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.495 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 69.3 t60 -65.41 -57.48 8.23 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.847 179.94 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -68.94 -13.7 62.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.184 -179.775 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -67.06 -63.37 1.07 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.422 -179.288 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 17.5 mtmt -79.87 -8.21 59.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.424 -178.977 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.495 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 17.8 tp10 -83.53 -43.94 15.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.832 0.348 . . . . 0.0 110.982 -179.945 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -78.74 0.19 27.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.08 -179.909 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -78.08 -52.87 8.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.044 -179.942 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 28.4 mm-40 -83.87 -71.5 0.5 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.895 -179.981 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -79.31 96.76 6.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.886 179.978 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -75.72 82.35 2.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.157 -179.955 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 8.7 p -94.44 -21.36 5.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.938 179.921 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -80.74 142.3 33.96 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.025 179.902 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 32.8 m -76.11 -41.27 50.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.884 -179.93 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -90.68 96.45 10.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.144 -179.96 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 3.0 p -101.98 -63.39 1.16 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.875 179.987 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -94.56 75.07 0.99 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.88 -0.676 . . . . 0.0 112.432 179.867 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 15.2 m -99.07 148.68 34.93 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 120.612 0.244 . . . . 0.0 111.083 -179.898 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -56.93 142.59 93.42 Favored 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.578 2.185 . . . . 0.0 112.32 -179.804 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.1 m -91.84 119.05 31.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.796 179.745 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.3 p . . . . . 0 C--O 1.248 1.019 0 CA-C-O 117.989 -1.005 . . . . 0.0 111.085 -179.799 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 2.5 t . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.783 0.325 . . . . 0.0 110.951 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 2.0 t -84.3 157.92 3.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.042 -179.956 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.81 22.47 4.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.856 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 4' ' ' SER . . . . . 0.444 ' HB3' ' HB2' ' B' ' 10' ' ' ALA . 0.9 OUTLIER -93.19 158.82 15.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.089 -179.808 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -113.76 -58.58 2.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.943 179.967 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.42 HD13 ' HA ' ' B' ' 6' ' ' LEU . 0.0 OUTLIER -66.23 -79.16 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.943 179.829 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 7' ' ' ASN . . . . . 0.814 ' HB2' HD23 ' A' ' 47' ' ' LEU . 2.2 t30 -84.16 127.05 68.21 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.051 -179.841 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -78.65 5.03 5.88 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.236 1.957 . . . . 0.0 111.899 178.593 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -123.54 43.02 3.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.917 179.945 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 10' ' ' ALA . . . . . 0.555 ' HB1' ' HB2' ' A' ' 46' ' ' MET . . . -59.78 85.26 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.702 -179.768 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.618 ' C ' ' HA ' ' A' ' 46' ' ' MET . 0.4 OUTLIER -117.61 128.13 54.63 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.051 178.537 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 12' ' ' GLU . . . . . 0.616 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 6.2 tt0 -46.56 167.47 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -175.846 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 13' ' ' PHE . . . . . 0.921 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.4 OUTLIER -87.41 90.16 8.26 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.206 -0.906 . . . . 0.0 109.91 179.605 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 14' ' ' VAL . . . . . 0.614 ' H ' ' HD2' ' B' ' 15' ' ' PRO . 4.0 t -124.66 -52.68 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.331 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -177.388 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 15' ' ' PRO . . . . . 0.614 ' HD2' ' H ' ' B' ' 14' ' ' VAL . 94.8 Cg_exo -44.98 -36.08 10.87 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 122.382 2.055 . . . . 0.0 112.678 -178.861 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 16' ' ' GLY . . . . . 0.485 ' O ' ' HB2' ' A' ' 21' ' ' LYS . . . 76.06 -14.82 5.81 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.412 -179.929 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 2.9 m -96.3 -174.83 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.57 0.224 . . . . 0.0 110.618 179.358 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.479 ' HG3' HD22 ' B' ' 21' ' ' ASN . 0.0 OUTLIER -60.1 89.31 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.956 0.408 . . . . 0.0 110.724 179.984 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.468 ' CE1' ' HG2' ' B' ' 15' ' ' PRO . 0.1 OUTLIER -75.66 118.78 18.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.974 -179.351 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 78.76 53.19 4.69 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.458 -179.964 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 21' ' ' ASN . . . . . 0.479 HD22 ' HG3' ' B' ' 18' ' ' LYS . 2.7 t-20 -98.3 -65.98 0.93 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.09 0.472 . . . . 0.0 111.068 -179.871 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 5.9 pt . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.217 -0.896 . . . . 0.0 111.03 -179.977 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.177 0 N-CA-C 112.497 -0.241 . . . . 0.0 112.497 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -69.83 -23.25 30.67 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.451 2.101 . . . . 0.0 112.274 179.921 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.35 89.45 7.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.863 179.992 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -80.1 78.87 1.77 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.531 -179.948 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.664 ' HB3' ' HD3' ' A' ' 6' ' ' PRO . 33.8 t -82.35 -50.91 0.78 Allowed Pre-proline 0 CA--C 1.533 0.298 0 N-CA-C 111.342 0.127 . . . . 0.0 111.342 -179.998 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.664 ' HD3' ' HB3' ' A' ' 5' ' ' SER . 24.2 Cg_exo -64.22 105.05 0.55 Allowed 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 122.222 1.948 . . . . 0.0 112.346 -179.872 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.437 ' O ' ' HG3' ' A' ' 11' ' ' MET . 2.9 mm? -90.03 -65.1 1.05 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.619 179.413 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.785 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 8.9 t -87.99 -29.17 20.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.07 179.433 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.46 -39.47 83.76 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 176.41 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 7.3 t -67.97 -34.62 76.89 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.734 177.111 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.785 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 9.2 mtm -64.43 -39.18 93.35 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.224 178.07 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.833 HD21 ' HB3' ' A' ' 24' ' ' LEU . 38.5 mt -52.27 -45.91 65.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.406 -179.9 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.15 -33.66 76.28 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.02 178.439 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.9 m -101.52 19.95 16.97 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.559 -179.098 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.454 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -136.52 114.13 10.34 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.096 -179.97 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.422 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 53.8 Cg_exo -52.72 167.73 0.57 Allowed 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.65 2.233 . . . . 0.0 112.345 179.733 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_exo -57.08 -31.04 89.1 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.542 2.161 . . . . 0.0 112.62 -179.527 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -73.98 -8.26 55.46 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.193 -179.581 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.469 ' O ' ' HB3' ' A' ' 22' ' ' GLN . 0.3 OUTLIER -87.53 13.16 10.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.158 -179.553 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.442 ' HG3' ' H ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -46.74 -68.77 0.16 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.351 179.853 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.545 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.54 -20.23 12.5 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.775 -177.195 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.545 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 14.9 tt0 -73.35 -80.05 0.07 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.963 0.411 . . . . 0.0 111.533 179.153 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.624 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.85 -94.14 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 -176.775 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.833 ' HB3' HD21 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -61.63 1.6 0.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -174.98 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.642 ' CA ' HD21 ' A' ' 48' ' ' LEU . . . 65.1 -117.52 10.47 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 108.598 -1.801 . . . . 0.0 108.598 -174.856 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.492 ' HG2' HG22 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -75.42 -67.25 0.68 Allowed 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 168.985 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.947 ' HG3' HD21 ' A' ' 31' ' ' LEU . 8.7 tpt180 -160.3 6.04 0.08 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.188 -1.369 . . . . 0.0 107.862 174.859 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.825 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.4 OUTLIER -60.01 -75.29 0.06 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.235 -1.348 . . . . 0.0 114.582 -172.175 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.496 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.2 OUTLIER -32.86 -50.81 0.63 Allowed Pre-proline 0 N--CA 1.468 0.468 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -175.484 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.615 ' HG2' ' O ' ' A' ' 27' ' ' ARG . 16.9 Cg_endo -60.25 -40.27 60.72 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 122.132 1.888 . . . . 0.0 113.167 -178.413 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.947 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.16 -48.42 51.97 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.136 179.844 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.726 HD11 HD23 ' A' ' 28' ' ' LEU . 0.9 OUTLIER -68.47 -20.61 25.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.229 -0.442 . . . . 0.0 109.892 178.045 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.658 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -63.44 -32.31 73.72 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 176.839 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.71 -26.04 63.22 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 174.903 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.465 ' HE1' ' HB ' ' A' ' 69' ' ' VAL . 10.2 mtt -102.03 14.07 32.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.559 -1.2 . . . . 0.0 109.749 177.471 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.788 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 0.0 OUTLIER -62.51 -36.39 26.91 Favored Pre-proline 0 CA--C 1.533 0.293 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.946 -179.388 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.788 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 1.3 Cg_endo -42.5 -26.98 0.67 Allowed 'Trans proline' 0 C--N 1.362 1.246 0 C-N-CA 121.969 1.779 . . . . 0.0 110.691 177.435 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.522 HG21 HG11 ' A' ' 73' ' ' VAL . 0.9 OUTLIER -81.93 -82.12 0.14 Allowed 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.37 175.376 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.439 ' H ' ' HB ' ' A' ' 38' ' ' THR . 0.2 OUTLIER -172.19 65.69 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 178.347 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.477 ' HA ' HD12 ' A' ' 43' ' ' ILE . . . -64.15 -172.52 0.07 Allowed 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 176.098 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.807 ' O ' HG22 ' A' ' 44' ' ' THR . . . 108.38 -106.75 2.38 Favored Glycine 0 C--O 1.227 -0.335 0 C-N-CA 120.172 -1.014 . . . . 0.0 113.056 179.476 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.469 ' HA ' ' HD3' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -56.8 -22.51 36.72 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.659 0.266 . . . . 0.0 111.622 -178.077 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.654 HG12 ' HB2' ' A' ' 76' ' ' LEU . 40.7 mt -54.09 -46.2 66.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.76 0.314 . . . . 0.0 110.934 179.684 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.825 ' HA ' HD22 ' A' ' 28' ' ' LEU . 15.4 t -57.14 -44.81 83.74 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.264 -179.606 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -49.36 -43.53 34.79 Favored Glycine 0 CA--C 1.519 0.288 0 C-N-CA 121.2 -0.524 . . . . 0.0 113.766 -178.305 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.514 ' H ' ' HG2' ' A' ' 46' ' ' MET . 0.0 OUTLIER -76.1 -51.9 11.27 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -177.54 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.766 ' HB2' HD21 ' A' ' 28' ' ' LEU . 2.8 mm? -79.67 -0.05 32.35 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.985 -178.693 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.642 HD21 ' CA ' ' A' ' 25' ' ' GLY . 0.2 OUTLIER -66.19 -15.68 63.35 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 121.381 0.61 . . . . 0.0 109.938 177.66 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.549 ' HG2' ' HZ2' ' B' ' 11' ' ' LYS . 0.6 OUTLIER -74.6 17.08 0.22 Allowed 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.572 179.233 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.625 HD11 ' HE3' ' A' ' 68' ' ' LYS . 1.2 tt -84.59 170.35 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.75 179.368 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.624 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 6.9 m-20 -71.56 147.18 47.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.913 0.387 . . . . 0.0 111.721 179.993 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.776 ' HA ' HD23 ' A' ' 55' ' ' LEU . 2.1 t-20 -78.56 -30.84 47.04 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 176.771 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.568 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 0.6 OUTLIER -74.14 -30.46 62.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.395 0.617 . . . . 0.0 109.825 177.234 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.624 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -79.22 -22.67 44.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.364 179.068 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.883 HD13 ' HB2' ' A' ' 27' ' ' ARG . 0.6 OUTLIER -63.53 -47.82 80.07 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.392 179.258 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.661 ' HA ' HD11 ' A' ' 59' ' ' LEU . 2.3 pp -61.29 -41.45 96.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.907 0.384 . . . . 0.0 110.266 179.455 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.0 -13.09 56.96 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.947 178.78 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.583 ' HB2' ' O ' ' A' ' 55' ' ' LEU . 22.4 mmt -76.45 -57.38 3.9 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.473 -179.494 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.881 ' H ' HD13 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -64.3 -10.79 26.33 Favored 'General case' 0 N--CA 1.463 0.176 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.206 179.286 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.54 ' N ' HD22 ' A' ' 59' ' ' LEU . 2.6 tp10 -92.44 -19.12 22.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.276 178.186 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.634 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 1.3 t -122.78 88.48 50.22 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.917 179.369 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -62.5 -31.27 80.42 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.281 1.987 . . . . 0.0 112.202 179.803 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -77.8 -48.44 16.56 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.424 -179.653 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.44 ' O ' ' HB2' ' A' ' 67' ' ' SER . 16.9 m -68.95 -47.73 64.94 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.027 0.442 . . . . 0.0 111.093 -178.935 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.703 ' CD1' HD13 ' A' ' 31' ' ' LEU . 0.6 OUTLIER -57.93 -64.17 1.0 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.749 -0.66 . . . . 0.0 112.01 -178.575 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.625 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.9 OUTLIER -49.03 -32.24 9.03 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.233 -177.084 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.501 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 5.1 m -58.71 -45.27 89.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.163 0.506 . . . . 0.0 110.196 178.233 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.625 ' HE3' HD11 ' A' ' 50' ' ' ILE . 12.3 mtmm -65.48 -64.47 0.85 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.716 179.472 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.517 HG11 HG12 ' A' ' 32' ' ' ILE . 82.8 t -57.52 -20.16 13.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.358 -178.8 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.501 ' HB3' ' O ' ' A' ' 67' ' ' SER . 5.9 t70 -55.92 -51.3 68.11 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 176.468 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.442 ' O ' HG13 ' A' ' 75' ' ' VAL . 1.0 OUTLIER -68.95 -29.17 67.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.827 177.049 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.651 ' O ' HG22 ' A' ' 75' ' ' VAL . . . -58.61 -40.98 84.81 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.32 178.543 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.621 ' HA ' HD13 ' A' ' 43' ' ' ILE . 24.8 t -62.24 -32.22 54.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 177.061 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.408 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -70.52 -38.63 74.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.289 179.394 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.651 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.9 -27.96 36.86 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 CA-C-O 120.995 0.426 . . . . 0.0 110.337 179.556 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.654 ' HB2' HG12 ' A' ' 43' ' ' ILE . 2.8 tm? -71.07 -48.76 50.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.317 178.865 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -60.1 -33.24 71.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.711 179.914 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.89 -20.08 42.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.871 179.138 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.453 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 12.4 t-80 -63.1 -61.67 2.22 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.879 -179.93 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -71.88 -10.34 59.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.085 -179.991 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -75.68 -56.59 4.54 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.317 -179.617 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.27 -12.89 59.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.352 -179.263 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.453 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 0.9 OUTLIER -86.09 -49.57 7.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.057 -179.641 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -76.86 2.36 14.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.163 -179.877 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.63 -24.01 66.94 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.06 179.897 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -78.37 -32.66 49.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.938 179.933 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -93.64 38.73 1.06 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.862 179.938 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -85.54 37.98 0.72 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.115 -179.919 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.2 t -78.76 133.31 30.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.131 -179.88 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -84.07 -51.79 6.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.833 179.91 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -90.58 76.29 6.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.811 179.777 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -79.21 -61.11 2.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.998 179.942 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 14.7 p -96.74 158.71 15.3 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.826 179.981 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -87.05 -40.08 7.18 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.462 179.99 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.8 t -107.28 115.93 58.94 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 120.584 0.23 . . . . 0.0 111.094 -179.928 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -79.06 65.02 8.9 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.626 2.217 . . . . 0.0 112.392 179.874 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.84 HG23 HG22 ' A' ' 98' ' ' VAL . 2.4 t -81.32 -35.28 31.16 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.93 -179.891 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.84 HG22 HG23 ' A' ' 97' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.005 0 CA-C-O 117.925 -1.036 . . . . 0.0 110.979 179.885 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 1.6 m . . . . . 0 N--CA 1.487 1.415 0 CA-C-O 120.813 0.339 . . . . 0.0 110.963 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' B' B ' 2' ' ' VAL . . . . . 0.436 HG22 ' O ' ' B' ' 2' ' ' VAL . 7.2 p -93.25 36.62 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.399 0.618 . . . . 0.0 110.824 -179.894 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 10.2 mttt -85.49 52.9 2.58 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.078 179.812 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 4' ' ' SER . . . . . 0.492 ' HB2' ' HB2' ' B' ' 10' ' ' ALA . 4.9 t -85.79 173.57 9.95 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.909 179.905 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -108.49 -47.71 3.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.923 -179.981 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.586 HD11 ' O ' ' A' ' 68' ' ' LYS . 35.7 mt -75.98 -79.28 0.1 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.933 -179.97 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 7' ' ' ASN . . . . . 0.511 ' HA ' ' HD3' ' B' ' 8' ' ' PRO . 1.4 t-20 -79.49 127.76 77.33 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.273 -179.36 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.511 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 5.9 Cg_exo -79.76 0.43 10.03 Favored 'Trans proline' 0 N--CA 1.459 -0.508 0 C-N-CA 122.744 2.296 . . . . 0.0 112.072 179.502 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 9' ' ' ASN . . . . . 0.538 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 44.0 m-20 -123.51 48.82 1.79 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.877 179.845 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 10' ' ' ALA . . . . . 0.51 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.89 99.13 0.08 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.081 -0.508 . . . . 0.0 112.068 -179.697 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.549 ' HZ2' ' HG2' ' A' ' 49' ' ' GLU . 0.1 OUTLIER -128.0 -178.37 4.49 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 120.776 0.322 . . . . 0.0 110.987 177.432 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -68.61 176.98 2.65 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 121.001 0.429 . . . . 0.0 111.459 -179.55 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 13' ' ' PHE . . . . . 0.421 ' CD1' HD13 ' A' ' 48' ' ' LEU . 1.0 OUTLIER -93.51 112.37 24.25 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.13 178.053 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 3.0 m -112.97 87.43 10.37 Favored Pre-proline 0 C--N 1.327 -0.396 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.487 179.322 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 15' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -55.82 -167.13 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 123.048 2.499 . . . . 0.0 113.08 -178.52 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 16' ' ' GLY . . . . . 0.459 ' O ' ' HE3' ' A' ' 21' ' ' LYS . . . 85.07 -56.08 4.98 Favored Glycine 0 N--CA 1.451 -0.336 0 CA-C-N 115.628 -0.714 . . . . 0.0 112.267 -179.297 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 15.7 m -115.94 157.7 16.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.805 0.336 . . . . 0.0 111.321 179.802 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 3.9 mtpp -68.99 92.92 0.54 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.464 178.877 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.426 ' OH ' ' HG3' ' B' ' 11' ' ' LYS . 0.3 OUTLIER -65.06 125.38 24.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.831 0.348 . . . . 0.0 110.738 -179.837 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' B' B ' 20' ' ' GLY . . . . . 0.508 ' HA3' ' HA ' ' A' ' 49' ' ' GLU . . . 93.9 41.23 4.42 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.285 -179.13 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -88.73 116.17 26.8 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.79 0.329 . . . . 0.0 110.973 -179.902 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 12.6 mt . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.265 -0.874 . . . . 0.0 111.064 -179.873 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.19 0 CA-C-O 120.173 -0.237 . . . . 0.0 112.528 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -74.68 165.38 85.8 Favored 'Cis proline' 0 C--N 1.349 0.584 0 C-N-CA 123.627 -1.405 . . . . 0.0 112.207 0.494 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -83.22 -57.71 3.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.951 179.999 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -105.13 68.32 0.26 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.439 179.942 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.4 t -84.1 122.76 75.89 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 120.624 0.25 . . . . 0.0 110.915 -179.761 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -69.98 79.89 0.98 Allowed 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.457 2.104 . . . . 0.0 112.226 179.638 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.453 ' HB3' ' H ' ' A' ' 8' ' ' THR . 4.8 mt -95.7 -147.96 0.29 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.753 -179.904 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.801 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 13.1 t -87.97 -29.65 20.62 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 179.99 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.434 ' HB2' ' OE1' ' A' ' 33' ' ' GLN . . . -59.45 -35.66 74.48 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 176.869 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 26.8 t -72.96 -34.83 66.74 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.849 177.572 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.801 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 4.8 mtm -64.33 -38.72 92.04 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.013 178.189 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.815 HD21 ' HB3' ' A' ' 24' ' ' LEU . 37.3 mt -52.61 -51.29 60.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.099 179.37 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.25 -28.14 68.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.827 177.953 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.66 20.46 16.15 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.77 -178.702 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.697 ' HB1' ' CB ' ' A' ' 19' ' ' GLU . . . -134.44 59.84 39.15 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 120.612 0.244 . . . . 0.0 111.12 -179.924 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.483 ' HD3' ' N ' ' A' ' 15' ' ' ALA . 48.5 Cg_exo -57.3 -49.46 13.82 Favored 'Trans proline' 0 CA--C 1.537 0.647 0 C-N-CA 122.69 2.26 . . . . 0.0 113.964 -178.406 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.474 ' HD2' ' N ' ' A' ' 16' ' ' PRO . 43.2 Cg_endo -67.36 -162.36 0.07 OUTLIER 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 121.963 1.776 . . . . 0.0 112.544 -178.993 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -73.45 71.12 1.29 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.85 179.744 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.697 ' CB ' ' HB1' ' A' ' 15' ' ' ALA . 0.4 OUTLIER -104.18 5.2 34.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.871 -179.546 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -46.05 -65.73 0.51 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.375 -178.651 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.78 ' HD2' ' HA ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER -55.76 -24.88 37.92 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.265 -178.79 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.426 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 6.6 tp60 -73.62 -77.36 0.11 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.736 0.303 . . . . 0.0 111.648 179.164 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.728 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -67.24 -97.06 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 112.543 0.571 . . . . 0.0 112.543 -176.375 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.898 HD12 ' HD3' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -62.09 1.07 0.33 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 113.604 0.965 . . . . 0.0 113.604 -175.525 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.695 ' HA3' HD21 ' A' ' 48' ' ' LEU . . . 64.71 -118.47 12.55 Favored Glycine 0 N--CA 1.445 -0.757 0 N-CA-C 108.435 -1.866 . . . . 0.0 108.435 -174.865 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 51' ' ' ASP . 1.8 mp0 -75.78 -68.45 0.57 Allowed 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 168.831 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.898 ' HD3' HD12 ' A' ' 24' ' ' LEU . 8.4 tpt85 -160.24 13.26 0.12 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 113.986 -1.461 . . . . 0.0 107.814 174.59 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.807 HD12 ' HA ' ' A' ' 44' ' ' THR . 1.4 mm? -56.98 -80.23 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 114.568 -1.196 . . . . 0.0 113.627 -173.125 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.8 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -36.14 -49.78 1.67 Allowed Pre-proline 0 CA--C 1.537 0.447 0 N-CA-C 113.626 0.972 . . . . 0.0 113.626 -174.501 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.75 ' HB2' ' NH1' ' A' ' 27' ' ' ARG . 50.6 Cg_exo -58.03 -40.92 73.4 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.209 1.939 . . . . 0.0 113.938 -177.852 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.815 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.86 -47.24 60.37 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 120.343 -0.543 . . . . 0.0 109.906 -179.195 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.546 ' O ' ' HB2' ' A' ' 40' ' ' ALA . 0.3 OUTLIER -74.14 -13.52 15.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.049 178.5 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.634 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 1.5 tt0 -61.46 -42.01 98.1 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 108.55 -0.908 . . . . 0.0 108.55 177.357 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.93 -30.2 70.27 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.077 174.958 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.526 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 6.7 mtt -100.25 26.11 6.88 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.52 178.364 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.634 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.6 p-80 -63.81 -32.82 8.49 Favored Pre-proline 0 CA--C 1.537 0.445 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -177.726 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.616 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 49.2 Cg_exo -34.56 -35.49 0.1 OUTLIER 'Trans proline' 0 C--N 1.363 1.324 0 C-N-CA 122.316 2.011 . . . . 0.0 112.258 178.897 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.416 ' HB ' ' H ' ' A' ' 39' ' ' LEU . 13.2 m -77.9 -86.11 0.06 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.631 176.547 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.75 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -171.58 65.22 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.302 178.003 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.546 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -49.78 -33.67 17.1 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.452 179.655 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.592 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -50.5 -56.3 13.7 Favored Glycine 0 C--N 1.33 0.201 0 CA-C-N 115.973 -0.558 . . . . 0.0 114.046 -178.294 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.567 ' HE2' ' SD ' ' A' ' 46' ' ' MET . 2.0 tptm -77.54 -38.75 48.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 117.128 0.464 . . . . 0.0 111.952 -177.637 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.673 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 18.3 mt -54.33 -56.21 11.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 121.203 -0.199 . . . . 0.0 111.399 -178.698 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.807 ' HA ' HD12 ' A' ' 28' ' ' LEU . 5.8 t -47.69 -47.7 29.57 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 178.552 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.664 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -49.41 -65.48 2.75 Favored Glycine 0 N--CA 1.451 -0.331 0 CA-C-N 115.656 -0.702 . . . . 0.0 113.621 -179.826 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.656 ' HG3' HD12 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -54.48 -71.23 0.08 Allowed 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 -176.599 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.867 HD23 ' HB2' ' B' ' 7' ' ' ASN . 3.7 mp -66.87 6.17 0.54 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -176.621 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.695 HD21 ' HA3' ' A' ' 25' ' ' GLY . 0.2 OUTLIER -66.84 -1.57 4.1 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.051 0.453 . . . . 0.0 110.539 177.125 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.602 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 1.2 mm-40 -81.99 19.08 1.19 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.579 176.716 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.475 HD11 ' HE3' ' A' ' 68' ' ' LYS . 2.0 tt -82.28 165.1 2.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.175 -178.412 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.453 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 34.5 m-20 -70.42 160.95 31.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.731 -178.751 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.81 ' HA ' HD23 ' A' ' 55' ' ' LEU . 5.1 m120 -87.22 -30.29 21.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.872 177.375 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.6 t -73.86 -29.03 61.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.791 177.714 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.434 ' HG3' ' HB2' ' A' ' 51' ' ' ASP . 4.3 mt-10 -79.65 -29.26 40.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.555 178.804 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.81 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.5 OUTLIER -58.88 -46.49 87.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.976 0.417 . . . . 0.0 110.07 179.395 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.486 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 1.9 tm? -62.62 -41.76 99.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.192 178.623 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.502 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 0.9 OUTLIER -60.88 -34.98 75.45 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.537 178.897 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.57 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -68.91 -43.49 75.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.171 178.758 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.621 HD13 ' NH2' ' A' ' 27' ' ' ARG . 5.4 tp -69.79 -15.1 63.06 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.663 179.49 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.502 ' HG2' ' O ' ' A' ' 57' ' ' HIS . 4.6 pt-20 -102.53 -7.92 21.47 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.009 179.456 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.57 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -125.58 89.02 53.26 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.99 179.65 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -61.69 -32.92 86.94 Favored 'Trans proline' 0 C--N 1.343 0.261 0 C-N-CA 122.266 1.977 . . . . 0.0 111.997 179.538 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -78.05 -48.4 16.19 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.489 -179.683 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.413 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 15.5 m -69.37 -52.18 29.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.956 0.408 . . . . 0.0 111.397 -178.641 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.787 HD11 ' HB3' ' A' ' 31' ' ' LEU . 0.1 OUTLIER -58.1 -57.81 11.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.316 -178.53 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.686 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.5 OUTLIER -51.8 -33.81 37.3 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.492 -178.936 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.589 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 3.9 m -69.71 -35.96 75.5 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.142 0.496 . . . . 0.0 110.094 177.818 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.58 ' HG2' HD21 ' B' ' 6' ' ' LEU . 0.1 OUTLIER -66.09 -56.78 9.79 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.992 178.233 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.541 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 49.1 t -67.7 -15.18 19.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.489 178.585 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.655 ' O ' HG22 ' A' ' 73' ' ' VAL . 10.7 t70 -57.62 -49.42 76.49 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 176.362 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.443 ' O ' HG13 ' A' ' 75' ' ' VAL . 22.0 tt0 -68.34 -26.49 65.62 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.44 176.476 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.673 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -62.43 -43.64 98.33 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.183 179.699 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.655 HG22 ' O ' ' A' ' 70' ' ' ASP . 2.8 m -62.7 -30.58 49.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.941 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -68.99 -36.57 77.98 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.037 178.872 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.65 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -60.21 -32.31 50.32 Favored 'Isoleucine or valine' 0 C--O 1.231 0.121 0 CA-C-O 121.025 0.441 . . . . 0.0 110.175 179.218 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.75 ' HG ' ' HB3' ' A' ' 39' ' ' LEU . 2.6 tm? -71.75 -47.93 50.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.203 178.51 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -55.79 -36.99 68.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.51 179.343 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.49 -15.62 54.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.205 179.527 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.479 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 0.6 OUTLIER -64.74 -54.44 31.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.804 0.335 . . . . 0.0 111.024 -179.618 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 11.6 mp0 -62.73 -10.32 12.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.859 -178.828 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -60.21 -68.66 0.27 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.712 0.291 . . . . 0.0 110.96 179.713 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.424 ' HE2' HG11 ' B' ' 2' ' ' VAL . 0.0 OUTLIER -79.48 -12.34 59.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.894 179.689 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.479 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -84.73 -12.59 53.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.809 179.726 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.61 -23.0 67.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.033 179.908 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -72.42 -11.17 60.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.006 179.992 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -91.36 -48.6 6.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.858 -179.982 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt -92.48 109.83 21.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.958 -179.812 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -85.21 84.95 7.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.89 179.648 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -95.06 165.73 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.093 -179.822 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -79.84 -20.07 46.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.925 179.923 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 9.1 t -94.83 57.35 2.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.863 179.994 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -91.79 29.01 1.64 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.094 -179.881 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.19 3.04 51.67 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.946 -179.962 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -81.55 -39.63 12.04 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.492 179.854 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 12.3 m -87.72 151.22 49.81 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 120.462 0.172 . . . . 0.0 111.03 179.913 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -72.26 157.71 97.54 Favored 'Cis proline' 0 C--N 1.349 0.588 0 C-N-CA 123.898 -1.292 . . . . 0.0 112.333 0.77 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 72.7 p -79.82 150.79 30.58 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.909 -179.929 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 27.0 m . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.109 -0.948 . . . . 0.0 111.124 -179.988 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' B' B ' 1' ' ' VAL . . . . . 0.678 HG11 ' HD3' ' B' ' 11' ' ' LYS . 5.8 m . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.878 0.37 . . . . 0.0 111.102 . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 2' ' ' VAL . . . . . 0.424 HG11 ' HE2' ' A' ' 82' ' ' LYS . 0.1 OUTLIER -99.82 175.94 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.969 179.806 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -94.34 119.09 32.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.968 -179.873 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 4' ' ' SER . . . . . 0.497 ' HB2' ' HB2' ' B' ' 10' ' ' ALA . 4.7 t -86.16 -168.8 2.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.92 -179.84 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -108.34 -54.29 2.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.044 -179.62 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.58 HD21 ' HG2' ' A' ' 68' ' ' LYS . 41.7 tp -76.41 -76.31 0.17 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.812 179.995 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 7' ' ' ASN . . . . . 0.867 ' HB2' HD23 ' A' ' 47' ' ' LEU . 2.1 t30 -83.4 122.27 77.03 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.74 179.341 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.472 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 5.2 Cg_exo -77.61 7.37 3.89 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 122.543 2.162 . . . . 0.0 111.858 179.381 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 9' ' ' ASN . . . . . 0.405 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 4.0 m120 -123.15 38.39 4.2 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.08 -179.593 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 10' ' ' ALA . . . . . 0.497 ' HB2' ' HB2' ' B' ' 4' ' ' SER . . . -59.57 89.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.852 -179.266 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.678 ' HD3' HG11 ' B' ' 1' ' ' VAL . 1.1 mmtp -125.71 129.96 50.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.828 177.952 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 12' ' ' GLU . . . . . 0.526 ' HG2' ' NZ ' ' A' ' 42' ' ' LYS . 6.6 mt-10 -46.63 170.72 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -176.282 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 13' ' ' PHE . . . . . 0.664 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.4 OUTLIER -86.45 94.2 9.34 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.163 178.946 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' B' B ' 14' ' ' VAL . . . . . 0.623 ' H ' ' HD2' ' B' ' 15' ' ' PRO . 42.5 t -130.26 -53.26 0.03 OUTLIER Pre-proline 0 C--N 1.327 -0.397 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -175.992 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 15' ' ' PRO . . . . . 0.623 ' HD2' ' H ' ' B' ' 14' ' ' VAL . 97.3 Cg_exo -44.56 -30.24 3.85 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 122.316 2.011 . . . . 0.0 112.987 -177.784 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 16' ' ' GLY . . . . . 0.494 ' O ' ' HB2' ' A' ' 21' ' ' LYS . . . 72.59 -13.22 3.07 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.236 -179.56 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.78 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 26.4 m -107.78 -172.09 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.546 0.213 . . . . 0.0 110.452 179.268 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.37 91.52 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.893 0.378 . . . . 0.0 110.839 -179.846 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.449 ' CD1' ' HG2' ' B' ' 15' ' ' PRO . 0.1 OUTLIER -77.89 125.19 28.98 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.996 -179.696 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 88.14 43.05 5.74 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.491 -179.817 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -91.82 109.93 21.27 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.77 0.319 . . . . 0.0 110.961 -179.931 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 7.5 mt . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.238 -0.887 . . . . 0.0 111.087 179.897 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.188 0 CA-C-O 120.097 -0.28 . . . . 0.0 112.481 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -73.2 -47.56 0.31 Allowed 'Cis proline' 0 C--N 1.348 0.508 0 C-N-CA 123.585 -1.423 . . . . 0.0 112.256 0.449 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -90.94 163.36 14.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.859 179.947 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -105.4 61.15 0.37 Allowed Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.502 -179.967 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -89.36 150.41 44.63 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 120.571 0.224 . . . . 0.0 110.9 179.982 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.18 -7.64 17.89 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.564 2.176 . . . . 0.0 112.344 179.958 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.745 HD23 ' HB2' ' A' ' 10' ' ' SER . 1.6 mp -80.86 99.55 8.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.849 179.878 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.761 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 15.1 t -87.71 -35.52 17.9 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.257 -179.681 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.405 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.5 -36.25 75.69 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 176.566 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.745 ' HB2' HD23 ' A' ' 7' ' ' LEU . 16.8 t -67.77 -34.83 77.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.668 177.399 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.761 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 9.6 mtm -64.26 -37.34 87.12 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.006 177.696 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.791 HD11 ' HB3' ' A' ' 24' ' ' LEU . 2.0 mp -51.9 -47.67 64.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.096 179.364 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.26 -34.33 77.76 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.23 178.644 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.2 m -100.36 21.95 12.34 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.631 -178.63 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.691 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -136.92 121.84 12.73 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.012 179.568 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.416 ' HG2' ' OE1' ' A' ' 19' ' ' GLU . 19.1 Cg_endo -57.9 168.7 3.17 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.534 2.156 . . . . 0.0 111.948 179.518 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -56.76 -36.32 98.44 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.499 2.133 . . . . 0.0 112.306 -179.909 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -73.51 -9.19 58.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.152 -179.799 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.691 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 1.2 tp10 -86.27 10.31 15.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.287 -179.486 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.432 ' O ' HD23 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -51.02 -59.84 3.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.299 -179.92 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.469 ' H ' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -55.65 -21.47 18.16 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.514 -178.122 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.482 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 17.4 tt0 -73.2 -79.24 0.08 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.989 0.423 . . . . 0.0 111.512 179.206 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.669 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.32 -94.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.795 -0.638 . . . . 0.0 112.685 -176.935 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.791 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -62.02 -0.81 0.55 Allowed 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.434 0.902 . . . . 0.0 113.434 -175.363 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.533 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.86 -117.18 9.96 Favored Glycine 0 N--CA 1.444 -0.815 0 N-CA-C 108.474 -1.85 . . . . 0.0 108.474 -174.853 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.471 ' O ' HD13 ' A' ' 55' ' ' LEU . 0.7 OUTLIER -76.08 -68.73 0.55 Allowed 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 169.247 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.806 ' HG2' HD12 ' A' ' 59' ' ' LEU . 7.8 tpt180 -160.07 12.84 0.12 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 114.47 -1.241 . . . . 0.0 108.424 175.673 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.568 HD12 HD11 ' A' ' 32' ' ' ILE . 4.0 mm? -57.02 -78.89 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.622 -1.172 . . . . 0.0 113.623 -173.043 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.737 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -36.6 -48.92 1.85 Allowed Pre-proline 0 CA--C 1.537 0.452 0 N-CA-C 113.48 0.919 . . . . 0.0 113.48 -175.062 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.585 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 52.4 Cg_exo -56.62 -43.42 55.26 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.293 1.995 . . . . 0.0 113.719 -178.279 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.767 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.61 -46.08 64.06 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.169 0.509 . . . . 0.0 110.124 -178.242 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.681 HG21 HD12 ' A' ' 43' ' ' ILE . 0.3 OUTLIER -77.72 -12.38 13.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.453 179.105 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.625 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 11.2 tp60 -62.65 -38.67 91.19 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 176.654 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.73 -31.51 70.64 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.053 -0.976 . . . . 0.0 108.967 174.482 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.485 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 7.6 mtt -100.27 27.43 5.68 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.35 178.023 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.814 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 1.7 p-80 -63.63 -32.88 8.78 Favored Pre-proline 0 CA--C 1.536 0.423 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -177.869 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.814 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 3.4 Cg_exo -35.3 -32.82 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.284 0 C-N-CA 122.687 2.258 . . . . 0.0 112.211 179.488 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.402 ' N ' ' O ' ' A' ' 36' ' ' HIS . 45.4 m -78.09 -86.83 0.06 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.101 -0.499 . . . . 0.0 109.811 176.637 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.668 ' O ' HG13 ' A' ' 43' ' ' ILE . 6.1 tp -171.47 56.08 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.512 178.175 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.478 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -39.87 -34.7 0.29 Allowed 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -179.865 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.606 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.58 -58.96 6.96 Favored Glycine 0 CA--C 1.519 0.289 0 CA-C-N 116.058 -0.519 . . . . 0.0 114.021 -179.049 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.945 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.3 OUTLIER -77.48 -30.35 53.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 117.068 0.434 . . . . 0.0 111.574 -178.356 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.681 HD12 HG21 ' A' ' 32' ' ' ILE . 5.1 mt -57.19 -58.21 6.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.116 -179.271 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.599 HG21 ' CD2' ' A' ' 29' ' ' PHE . 5.3 t -47.72 -45.89 29.23 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.984 0.421 . . . . 0.0 110.526 178.661 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.744 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -50.86 -66.94 2.16 Favored Glycine 0 N--CA 1.452 -0.279 0 CA-C-N 115.511 -0.768 . . . . 0.0 113.709 -179.28 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.737 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.37 -49.99 70.86 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 117.047 0.423 . . . . 0.0 111.527 -177.744 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.48 HD22 ' N ' ' A' ' 47' ' ' LEU . 2.9 mm? -76.49 3.33 11.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.542 -178.389 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.541 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.29 -10.29 41.08 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.991 0.424 . . . . 0.0 110.55 179.545 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.414 ' HG3' ' O ' ' B' ' 9' ' ' ASN . 3.1 mm-40 -82.39 19.71 1.19 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.508 178.438 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.424 HG23 ' O ' ' A' ' 51' ' ' ASP . 1.1 tt -83.57 164.32 2.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.024 -179.409 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.424 ' O ' HG23 ' A' ' 50' ' ' ILE . 1.0 OUTLIER -70.97 157.95 37.33 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.498 -179.404 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.862 ' HA ' HD23 ' A' ' 55' ' ' LEU . 14.0 m-80 -86.1 -29.81 23.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.148 178.14 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -73.32 -33.77 65.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.232 0.539 . . . . 0.0 109.579 177.706 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.425 ' O ' ' SD ' ' A' ' 58' ' ' MET . 3.4 mt-10 -75.73 -29.25 58.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.688 178.945 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.862 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -58.46 -46.8 85.85 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.877 0.37 . . . . 0.0 110.213 -179.922 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.643 ' HA ' HD11 ' A' ' 59' ' ' LEU . 1.6 tt -59.5 -46.01 90.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.759 179.342 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.591 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 1.5 m80 -62.12 -16.91 55.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.548 -179.519 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.561 ' HB3' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -75.88 -56.53 4.59 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 -178.462 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.859 ' H ' HD13 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -64.38 -12.0 38.38 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.269 -0.573 . . . . 0.0 110.678 179.953 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.594 ' N ' HD22 ' A' ' 59' ' ' LEU . 2.4 pt-20 -98.7 -12.29 21.15 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.899 179.283 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.537 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.3 OUTLIER -122.96 92.04 49.42 Favored Pre-proline 0 C--N 1.332 -0.186 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.079 179.886 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.435 ' O ' ' HB2' ' A' ' 66' ' ' ARG . 36.0 Cg_endo -64.49 -31.29 61.24 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.337 2.025 . . . . 0.0 112.009 179.409 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.62 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.63 -47.14 17.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.267 179.895 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.62 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 15.1 m -70.95 -55.55 8.12 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.503 -178.564 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.767 HD21 HD13 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -58.19 -61.52 2.5 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.613 -178.184 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.661 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -50.26 -31.21 13.55 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.94 -178.043 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.522 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.6 OUTLIER -68.17 -40.76 82.2 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.1 0.476 . . . . 0.0 110.294 177.949 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.493 ' HD3' ' CE ' ' A' ' 58' ' ' MET . 30.0 mtpt -65.86 -59.38 3.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.566 179.299 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.527 ' CG1' HG23 ' A' ' 32' ' ' ILE . 44.8 t -60.53 -20.99 22.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.486 179.86 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.598 ' O ' HG22 ' A' ' 73' ' ' VAL . 28.3 t0 -55.61 -48.87 74.18 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.219 -0.659 . . . . 0.0 109.219 176.55 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.594 ' HB3' HD13 ' B' ' 6' ' ' LEU . 1.1 tt0 -68.98 -26.69 65.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.936 176.845 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.675 ' O ' HG22 ' A' ' 75' ' ' VAL . . . -62.35 -53.36 56.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.022 179.871 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.643 ' HA ' HD13 ' A' ' 43' ' ' ILE . 2.8 m -54.23 -29.4 19.34 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 177.356 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.514 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -70.78 -36.43 73.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.466 179.856 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.675 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.5 m -56.23 -28.37 25.6 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 178.673 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.945 HD11 ' HB3' ' A' ' 42' ' ' LYS . 1.6 mm? -71.83 -51.63 21.5 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.126 176.846 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -52.81 -35.16 56.55 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.854 178.507 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.403 ' O ' ' HB3' ' A' ' 81' ' ' ALA . . . -82.29 -21.46 36.15 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.185 178.173 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.469 ' O ' ' HB3' ' A' ' 83' ' ' GLU . 9.4 t-80 -58.84 -63.12 1.41 Allowed 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.886 -179.373 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 58.0 mt-30 -68.28 -3.06 9.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.329 -179.621 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.403 ' HB3' ' O ' ' A' ' 78' ' ' ALA . . . -79.74 -68.69 0.64 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.387 -179.49 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 6.6 mmtm -75.35 -18.02 60.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.586 -178.783 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.469 ' HB3' ' O ' ' A' ' 79' ' ' HIS . 9.2 tp10 -79.9 -50.17 10.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.066 -179.566 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -77.43 -1.77 31.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.185 -179.89 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -71.02 -43.39 68.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.962 179.971 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.16 83.38 6.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.867 -179.915 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.81 7.15 46.86 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.951 179.977 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -88.5 -1.81 58.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.171 -179.659 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.1 p -104.76 130.49 55.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.098 -179.929 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -104.54 125.46 50.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.899 179.884 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.431 ' HB2' ' H ' ' A' ' 92' ' ' ALA . 0.7 OUTLIER -95.11 -88.76 0.25 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.942 -179.989 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.431 ' H ' ' HB2' ' A' ' 91' ' ' SER . . . -92.87 -71.2 0.66 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.112 179.999 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 19.5 p -117.82 -169.98 1.78 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.864 -179.807 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -77.2 -120.4 0.19 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.506 179.984 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.2 m -107.73 122.1 42.02 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 120.625 0.25 . . . . 0.0 111.131 -179.99 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -70.64 78.04 1.34 Allowed 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.763 2.308 . . . . 0.0 112.138 -179.961 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.08 132.39 51.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.849 -179.929 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 1.3 m . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.138 -0.934 . . . . 0.0 111.084 179.813 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 7.2 p . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 120.894 0.378 . . . . 0.0 111.139 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' B' B ' 2' ' ' VAL . . . . . 0.445 HG21 ' O ' ' B' ' 8' ' ' PRO . 2.2 t -88.83 110.41 21.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.88 179.828 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.91 16.27 18.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.193 -179.354 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 30.3 m -93.65 158.04 15.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.992 179.678 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -103.97 -38.07 7.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.46 179.176 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.594 HD13 ' HB3' ' A' ' 71' ' ' GLU . 1.4 tp -75.23 -81.59 0.07 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.782 179.272 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 7' ' ' ASN . . . . . 0.447 ' HB2' ' CD1' ' A' ' 47' ' ' LEU . 1.2 t-20 -79.83 120.16 79.08 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.193 179.883 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.445 ' O ' HG21 ' B' ' 2' ' ' VAL . 73.6 Cg_endo -76.01 3.09 6.42 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.196 1.93 . . . . 0.0 111.67 178.415 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 9' ' ' ASN . . . . . 0.511 ' HB3' ' NZ ' ' B' ' 11' ' ' LYS . 5.4 m120 -123.3 48.09 1.89 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.477 179.354 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 10' ' ' ALA . . . . . 0.737 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -59.44 96.83 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.801 -179.087 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.511 ' NZ ' ' HB3' ' B' ' 9' ' ' ASN . 8.3 mttp -125.19 133.78 52.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.076 178.189 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 12' ' ' GLU . . . . . 0.62 ' HG2' ' HE3' ' A' ' 42' ' ' LYS . 44.9 mt-10 -48.29 165.43 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.033 0.444 . . . . 0.0 111.982 -178.591 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 13' ' ' PHE . . . . . 0.744 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.8 OUTLIER -87.32 83.9 7.29 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.435 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' B' B ' 14' ' ' VAL . . . . . 0.924 ' H ' ' HD2' ' B' ' 15' ' ' PRO . 1.7 m -125.85 -36.02 0.04 OUTLIER Pre-proline 0 CA--C 1.539 0.555 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 -174.648 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 15' ' ' PRO . . . . . 0.924 ' HD2' ' H ' ' B' ' 14' ' ' VAL . 12.1 Cg_endo -54.78 -34.08 83.31 Favored 'Trans proline' 0 C--N 1.355 0.887 0 C-N-CA 121.704 1.603 . . . . 0.0 112.576 -178.07 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 16' ' ' GLY . . . . . 0.438 ' O ' ' HB2' ' A' ' 21' ' ' LYS . . . 78.45 -23.67 2.81 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.279 -179.505 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.71 HG22 ' H ' ' B' ' 18' ' ' LYS . 2.1 p -94.77 -178.7 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 N-CA-C 110.309 -0.256 . . . . 0.0 110.309 179.403 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.71 ' H ' HG22 ' B' ' 17' ' ' VAL . 0.0 OUTLIER -59.55 94.65 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.891 0.377 . . . . 0.0 110.998 -179.174 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.431 ' CD1' ' HG3' ' B' ' 15' ' ' PRO . 0.1 OUTLIER -79.72 114.42 18.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.823 -179.771 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 89.45 36.31 7.53 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.282 -179.339 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -83.6 94.13 8.02 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.763 0.316 . . . . 0.0 110.922 -179.774 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.233 -0.889 . . . . 0.0 111.045 179.968 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.263 0 N-CA-C 112.508 -0.237 . . . . 0.0 112.508 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -59.58 -17.05 39.65 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.603 2.202 . . . . 0.0 112.333 -179.775 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 9.4 mt -83.09 -48.59 10.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.987 -179.813 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -84.56 58.15 5.0 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.5 -179.803 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -95.45 147.65 33.35 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 120.607 0.241 . . . . 0.0 110.9 179.953 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -69.82 8.19 0.84 Allowed 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.736 2.291 . . . . 0.0 112.528 -179.679 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.466 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.1 OUTLIER -82.84 39.94 0.66 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.174 -179.732 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.744 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 7.2 t -87.92 -33.09 18.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.484 -179.929 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.5 -36.89 76.92 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 176.948 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.0 t -68.93 -35.5 76.87 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.599 177.318 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.744 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.3 mtm -64.42 -36.05 82.9 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.972 177.506 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.727 ' HA ' ' HE2' ' A' ' 23' ' ' MET . 3.1 mp -52.15 -48.18 65.03 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.113 179.185 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.02 -33.86 76.78 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.15 178.846 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.7 m -101.5 25.53 8.3 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.715 -178.811 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.509 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -138.04 120.29 10.86 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.271 179.556 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.655 ' HG2' ' HB2' ' A' ' 19' ' ' GLU . 19.3 Cg_endo -59.55 167.82 6.04 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.61 2.207 . . . . 0.0 111.854 179.033 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.19 -40.95 83.08 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.552 2.168 . . . . 0.0 112.537 -179.66 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -73.18 -8.91 57.85 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.014 -179.778 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.655 ' HB2' ' HG2' ' A' ' 16' ' ' PRO . 1.4 tp10 -91.67 15.33 12.9 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.043 -179.637 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.516 ' O ' HD12 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -59.23 -49.27 78.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.011 0.434 . . . . 0.0 110.764 -179.723 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.525 ' HG3' ' O ' ' B' ' 17' ' ' VAL . 0.3 OUTLIER -56.82 -22.46 36.63 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.159 -179.303 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.543 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 12.5 tt0 -72.96 -76.5 0.12 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.946 0.403 . . . . 0.0 111.413 179.728 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.727 ' HE2' ' HA ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.73 -95.76 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -176.854 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.634 HD23 HD11 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -62.14 1.64 0.29 Allowed 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -175.602 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.55 -116.49 9.09 Favored Glycine 0 N--CA 1.444 -0.816 0 N-CA-C 108.226 -1.95 . . . . 0.0 108.226 -174.376 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.583 ' HB3' ' HB2' ' A' ' 55' ' ' LEU . 1.9 mp0 -75.75 -69.18 0.51 Allowed 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 168.814 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.94 ' HG3' HD21 ' A' ' 31' ' ' LEU . 23.3 tpt180 -160.25 8.9 0.1 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.132 -1.394 . . . . 0.0 107.458 175.416 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 1.002 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -58.28 -74.82 0.06 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.398 -1.274 . . . . 0.0 113.879 -172.259 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.63 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -38.54 -47.0 3.18 Favored Pre-proline 0 CA--C 1.536 0.441 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 -175.229 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.483 ' HD2' ' O ' ' A' ' 27' ' ' ARG . 52.2 Cg_exo -57.5 -42.04 65.41 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.172 1.915 . . . . 0.0 113.398 -179.126 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.94 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.79 -43.26 69.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.18 0.514 . . . . 0.0 109.833 -179.067 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.679 HG21 HD12 ' A' ' 43' ' ' ILE . 0.4 OUTLIER -77.01 -15.57 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.06 177.901 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.649 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 4.9 tt0 -63.17 -35.08 79.11 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 177.101 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.26 -30.19 65.99 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.011 -0.995 . . . . 0.0 108.651 174.676 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.51 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 7.7 mtt -100.12 24.66 8.35 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.881 177.539 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.649 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -64.65 -31.46 5.68 Favored Pre-proline 0 CA--C 1.535 0.377 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.694 -178.213 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.555 ' CD ' ' N ' ' A' ' 36' ' ' HIS . 64.5 Cg_exo -38.61 -27.65 0.12 Allowed 'Trans proline' 0 C--N 1.363 1.313 0 C-N-CA 121.98 1.786 . . . . 0.0 111.9 178.244 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.858 HG22 HD12 ' A' ' 39' ' ' LEU . 13.6 m -77.66 -95.32 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 175.8 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.858 HD12 HG22 ' A' ' 38' ' ' THR . 2.2 mp -154.59 42.34 0.49 Allowed 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 177.662 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -42.19 105.99 0.05 Allowed 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 178.065 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.63 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . 170.49 -63.75 0.17 Allowed Glycine 0 N--CA 1.447 -0.576 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.883 -176.846 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.698 ' HE3' ' HG2' ' B' ' 12' ' ' GLU . 0.0 OUTLIER -77.86 -30.6 50.99 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.745 0.307 . . . . 0.0 110.658 178.773 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.776 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 60.0 mt -54.05 -62.22 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.244 -179.711 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 44' ' ' THR . . . . . 1.002 ' HA ' HD22 ' A' ' 28' ' ' LEU . 9.9 t -47.1 -41.14 16.69 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.185 -179.471 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.704 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -53.3 -63.71 4.83 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.854 178.769 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.755 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.63 -51.06 68.47 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.686 0.279 . . . . 0.0 111.476 -178.548 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.494 ' HB2' HD21 ' A' ' 28' ' ' LEU . 2.3 mm? -78.67 4.8 12.64 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.772 -178.044 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.688 ' HB3' ' HD2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -66.25 -11.74 52.08 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.919 0.39 . . . . 0.0 110.62 179.371 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.443 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 3.2 mm-40 -74.64 13.5 0.61 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.265 177.605 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.525 HD11 ' HE3' ' A' ' 68' ' ' LYS . 0.1 OUTLIER -84.87 156.84 3.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.008 -179.66 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.457 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 1.1 m-20 -71.36 156.36 39.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.744 -179.817 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.822 ' HA ' HD23 ' A' ' 55' ' ' LEU . 2.0 m-80 -82.41 -22.8 35.21 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 121.266 0.555 . . . . 0.0 109.598 176.423 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -74.61 -37.33 62.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.325 0.583 . . . . 0.0 109.794 176.807 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.07 -22.57 58.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.304 179.348 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.822 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.4 OUTLIER -63.04 -48.17 79.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.882 178.56 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.526 ' O ' ' HG3' ' A' ' 60' ' ' GLU . 53.1 tp -55.28 -43.79 75.08 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.347 179.01 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -58.41 -41.17 84.34 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.056 179.226 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.521 ' HB3' ' HG ' ' A' ' 65' ' ' LEU . 24.4 mmt -60.12 -36.69 78.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.058 179.687 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.772 HD12 ' NE ' ' A' ' 27' ' ' ARG . 8.3 tt -70.9 -19.83 62.56 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.286 -179.19 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.526 ' HG3' ' O ' ' A' ' 56' ' ' LEU . 13.7 mt-10 -106.53 -3.72 20.52 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 -178.607 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.539 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.3 OUTLIER -122.52 83.08 47.44 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 120.602 0.239 . . . . 0.0 111.213 -179.447 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -59.94 -31.93 94.38 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.312 2.008 . . . . 0.0 111.945 179.237 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -78.09 -49.01 14.76 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.498 -179.793 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 47.4 m -70.58 -52.78 19.22 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.889 0.376 . . . . 0.0 111.439 -178.63 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.889 HD21 HD13 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -57.93 -62.24 1.95 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.26 -178.704 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.627 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.5 OUTLIER -50.71 -35.77 32.9 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.157 -177.831 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.61 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 4.2 m -67.96 -36.21 79.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.292 0.568 . . . . 0.0 110.049 178.127 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.525 ' HE3' HD11 ' A' ' 50' ' ' ILE . 9.7 ttpt -66.12 -57.67 7.15 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.11 178.556 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.621 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 42.0 t -65.21 -15.64 18.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.373 178.572 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.61 ' HB3' ' O ' ' A' ' 67' ' ' SER . 9.4 t70 -57.3 -48.98 77.55 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 176.313 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.558 ' HB3' HD13 ' B' ' 6' ' ' LEU . 4.5 tt0 -68.6 -21.97 64.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.673 176.515 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.776 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -63.95 -51.17 65.62 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.817 179.597 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.589 HG22 ' O ' ' A' ' 70' ' ' ASP . 2.6 m -56.15 -29.17 26.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 176.851 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.523 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -70.86 -32.47 69.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.055 178.64 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.717 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.6 m -57.06 -33.48 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 178.515 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.732 HD13 ' HB2' ' A' ' 39' ' ' LEU . 39.0 mt -66.56 -48.3 70.1 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 175.96 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 17.1 mm100 -54.72 -36.79 65.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.315 178.916 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.89 -20.69 38.32 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.159 178.57 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.465 ' O ' ' HB3' ' A' ' 83' ' ' GLU . 12.1 t-80 -59.08 -68.82 0.23 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.902 -179.381 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -63.55 -9.12 11.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.214 -179.755 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.55 -69.43 0.58 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.426 -179.67 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.1 -23.54 64.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.427 -178.95 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.465 ' HB3' ' O ' ' A' ' 79' ' ' HIS . 1.4 tt0 -74.66 -47.48 31.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.89 -179.577 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -79.95 -4.94 54.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.079 -179.939 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -73.7 -43.91 57.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.206 -179.879 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -82.11 -28.29 32.34 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.002 -179.683 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.13 8.36 8.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.955 -179.871 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -88.85 44.72 1.23 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.015 179.924 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -97.73 126.87 50.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.044 -179.983 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 32.5 m-20 -96.6 7.27 46.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.037 -179.97 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 99.6 p -79.15 -5.14 53.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.864 179.837 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.45 -18.52 63.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.114 -179.918 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.65 158.22 17.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.0 -179.987 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -80.8 92.45 1.44 Allowed Glycine 0 N--CA 1.451 -0.367 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.426 179.817 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.414 ' HA ' ' HD3' ' A' ' 96' ' ' PRO . 31.6 m -104.96 149.19 37.29 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 120.576 0.227 . . . . 0.0 111.159 -179.738 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 95' ' ' VAL . 22.4 Cg_exo -65.26 -160.58 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.687 2.258 . . . . 0.0 112.361 -179.841 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 75.5 p -85.16 -174.85 5.46 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.865 179.885 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 15.6 m . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.172 -0.918 . . . . 0.0 111.095 -179.947 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.907 0.384 . . . . 0.0 111.008 . . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 25.6 m -94.21 157.46 3.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.167 -179.975 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 9.0 mttm -93.83 94.3 8.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.013 -179.954 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 4' ' ' SER . . . . . 0.523 ' HB3' ' O ' ' B' ' 7' ' ' ASN . 9.3 t -73.72 -178.12 3.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.824 179.717 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 5' ' ' ASN . . . . . 0.432 ' HB3' ' HG2' ' A' ' 71' ' ' GLU . 0.3 OUTLIER -106.05 -52.66 2.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.029 -179.809 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.558 HD13 ' HB3' ' A' ' 71' ' ' GLU . 1.4 tp -74.45 -77.85 0.11 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.014 -179.75 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 7' ' ' ASN . . . . . 0.523 ' O ' ' HB3' ' B' ' 4' ' ' SER . 1.6 t-20 -83.71 138.33 40.88 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.026 179.867 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.481 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 5.6 Cg_exo -79.86 -7.78 14.44 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.75 2.3 . . . . 0.0 111.928 179.234 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 9' ' ' ASN . . . . . 0.579 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 64.8 m-20 -123.38 56.31 1.2 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.185 -179.76 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 10' ' ' ALA . . . . . 0.755 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.8 98.94 0.08 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.707 179.507 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.579 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.0 OUTLIER -124.99 156.47 38.05 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.471 178.446 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' B' B ' 12' ' ' GLU . . . . . 0.698 ' HG2' ' HE3' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -56.25 166.49 0.82 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.764 0.316 . . . . 0.0 111.416 -179.656 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' B' B ' 13' ' ' PHE . . . . . 0.704 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.1 t80 -88.67 64.15 7.23 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.681 179.84 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 14' ' ' VAL . . . . . 0.562 ' N ' ' CD ' ' B' ' 15' ' ' PRO . 1.3 t -131.53 33.31 0.24 Allowed Pre-proline 0 CA--C 1.539 0.544 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 178.322 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 15' ' ' PRO . . . . . 0.738 ' HG3' ' HB2' ' B' ' 19' ' ' TYR . 31.8 Cg_endo -58.25 -34.11 98.27 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 122.278 1.985 . . . . 0.0 113.123 179.599 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.76 -43.11 3.19 Favored Glycine 0 N--CA 1.449 -0.468 0 N-CA-C 110.864 -0.894 . . . . 0.0 110.864 -175.27 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.525 ' O ' ' HG3' ' A' ' 21' ' ' LYS . 21.4 m -116.73 -172.26 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 176.588 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.536 ' HG2' ' ND2' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -60.17 104.96 0.36 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.812 0.339 . . . . 0.0 110.849 179.385 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.738 ' HB2' ' HG3' ' B' ' 15' ' ' PRO . 0.2 OUTLIER -79.47 131.31 36.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.936 -179.86 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 86.68 10.4 73.08 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.543 -179.946 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -101.26 -17.07 16.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.839 0.352 . . . . 0.0 110.915 179.972 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 11.3 mm . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.247 -0.882 . . . . 0.0 111.108 -179.974 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.24 0 N-CA-C 112.516 -0.234 . . . . 0.0 112.516 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -63.86 101.75 0.34 Allowed 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.6 2.2 . . . . 0.0 112.282 179.947 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -93.72 26.67 3.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.932 179.904 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.77 33.25 4.25 Favored Glycine 0 N--CA 1.453 -0.22 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.42 179.946 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.66 -50.52 0.31 Allowed Pre-proline 0 C--N 1.33 -0.276 0 N-CA-C 111.521 0.193 . . . . 0.0 111.521 179.84 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_exo -67.7 82.26 0.43 Allowed 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.326 2.017 . . . . 0.0 112.341 -179.502 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.49 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.2 OUTLIER -100.02 108.32 20.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.412 179.169 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.741 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 5.8 t -87.9 -32.03 19.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.886 -178.513 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.23 -33.66 71.28 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 177.707 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -75.09 -34.98 61.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.94 177.574 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.741 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 9.0 mtm -64.42 -36.78 85.28 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.898 177.869 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.621 HD11 ' HB3' ' A' ' 24' ' ' LEU . 1.2 mp -52.59 -56.28 16.39 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.906 178.626 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.29 -25.27 66.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.881 178.202 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.6 m -101.61 23.7 10.83 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.834 -178.534 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.724 ' HB1' ' HB2' ' A' ' 19' ' ' GLU . . . -134.45 58.07 27.37 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.753 -0.203 . . . . 0.0 111.161 179.545 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.505 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 52.6 Cg_exo -53.88 -49.62 16.53 Favored 'Trans proline' 0 CA--C 1.537 0.625 0 C-N-CA 122.612 2.208 . . . . 0.0 113.626 -178.768 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.505 ' HD3' ' HB2' ' A' ' 16' ' ' PRO . 16.5 Cg_exo -68.32 -166.73 0.15 Allowed 'Trans proline' 0 C--N 1.355 0.887 0 C-N-CA 122.095 1.863 . . . . 0.0 112.198 -179.523 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -73.8 70.72 1.44 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.72 179.265 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.724 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 1.9 mm-40 -104.01 7.27 36.53 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.886 -179.47 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.644 HE22 ' HG3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -46.43 -61.0 2.0 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.223 -177.73 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.687 ' HD2' ' HA ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER -56.32 -25.02 47.44 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.293 -179.32 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.495 ' OE1' ' HG3' ' A' ' 23' ' ' MET . 2.9 tt0 -73.44 -75.56 0.14 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.844 0.354 . . . . 0.0 111.52 179.468 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.617 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.15 -96.58 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -176.309 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.621 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -61.96 0.73 0.35 Allowed 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 -175.532 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 65.0 -117.29 10.11 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 108.421 -1.872 . . . . 0.0 108.421 -174.322 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.433 ' O ' HD13 ' A' ' 24' ' ' LEU . 1.2 mp0 -75.91 -68.54 0.57 Allowed 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 169.401 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.971 ' HG2' HD22 ' A' ' 59' ' ' LEU . 1.7 tpt180 -160.06 11.75 0.12 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.216 175.537 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.485 ' O ' HG13 ' A' ' 32' ' ' ILE . 4.1 mm? -57.2 -78.45 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.608 -1.178 . . . . 0.0 113.49 -173.302 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.716 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -35.05 -48.33 1.04 Allowed Pre-proline 0 CA--C 1.539 0.521 0 N-CA-C 113.642 0.978 . . . . 0.0 113.642 -175.517 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.545 ' HG2' ' HD2' ' A' ' 27' ' ' ARG . 46.8 Cg_exo -59.69 -42.16 49.11 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 122.367 2.045 . . . . 0.0 113.736 -178.204 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.784 HD22 ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.61 -44.54 67.06 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 121.131 0.491 . . . . 0.0 109.97 -178.474 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.529 HG23 ' CG1' ' A' ' 69' ' ' VAL . 0.2 OUTLIER -76.9 -13.0 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.968 178.179 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.612 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 49.6 tp60 -62.33 -37.47 85.72 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 176.75 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.47 -32.5 71.46 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.139 174.749 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.54 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 7.0 mtt -100.13 28.75 4.68 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.203 177.85 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.612 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.2 OUTLIER -63.16 -32.15 8.1 Favored Pre-proline 0 CA--C 1.535 0.402 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -177.429 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.567 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 60.0 Cg_exo -36.65 -32.85 0.13 Allowed 'Trans proline' 0 C--N 1.362 1.275 0 C-N-CA 122.083 1.855 . . . . 0.0 112.27 179.23 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.511 HG22 HD12 ' A' ' 76' ' ' LEU . 86.6 m -78.26 -88.08 0.05 Allowed 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.8 176.836 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.681 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 0.1 OUTLIER -171.35 61.17 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.447 178.203 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.476 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -44.99 -34.24 2.36 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.848 0.356 . . . . 0.0 111.616 179.661 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.639 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -50.94 -58.16 9.88 Favored Glycine 0 C--N 1.33 0.243 0 CA-C-N 115.989 -0.551 . . . . 0.0 113.867 -178.995 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.494 ' H ' HD12 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -77.86 -34.35 51.74 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -177.867 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.65 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 36.1 mt -55.98 -55.43 18.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.715 -0.22 . . . . 0.0 111.481 -179.008 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.566 HG21 ' CD2' ' A' ' 29' ' ' PHE . 6.1 t -47.56 -44.18 25.91 Favored 'General case' 0 CA--C 1.522 -0.119 0 CA-C-O 121.006 0.432 . . . . 0.0 110.135 178.637 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.803 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -49.65 -65.39 2.85 Favored Glycine 0 N--CA 1.448 -0.501 0 CA-C-N 115.312 -0.858 . . . . 0.0 113.464 -179.862 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.615 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.33 -50.72 68.88 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -177.276 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.5 HD22 ' N ' ' A' ' 47' ' ' LEU . 2.9 mm? -79.06 6.2 10.04 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -177.917 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.559 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.21 -7.65 19.55 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.984 0.421 . . . . 0.0 110.622 179.195 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.436 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 3.3 mt-10 -81.96 16.8 1.75 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.664 178.437 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -83.16 158.82 3.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.816 -179.514 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -70.59 160.05 33.23 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.02 0.438 . . . . 0.0 111.838 -178.089 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.943 ' HA ' HD23 ' A' ' 55' ' ' LEU . 4.9 m120 -83.67 -31.39 26.17 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.448 178.738 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.1 t -74.01 -34.27 64.1 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.387 0.613 . . . . 0.0 109.523 177.516 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.442 ' OE2' ' HE3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -75.58 -28.65 59.03 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.645 179.367 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.943 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -59.34 -47.07 86.79 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 120.923 0.392 . . . . 0.0 110.003 179.124 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.684 ' HA ' HD21 ' A' ' 59' ' ' LEU . 2.2 tm? -56.33 -48.04 77.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.926 -179.844 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.45 ' O ' ' HB2' ' A' ' 61' ' ' SER . 15.4 t60 -58.05 -24.67 59.33 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.918 -179.119 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.631 ' HE2' ' HA ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -73.86 -58.17 3.48 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -177.542 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.971 HD22 ' HG2' ' A' ' 27' ' ' ARG . 2.2 pt? -65.59 -6.03 9.9 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.962 -179.024 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.542 ' HG3' HD13 ' A' ' 56' ' ' LEU . 13.4 mm-40 -106.68 -10.86 15.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.679 177.455 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.572 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.5 OUTLIER -122.5 97.83 44.3 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.137 179.75 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -64.06 -30.53 66.07 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.201 1.934 . . . . 0.0 112.028 179.07 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -78.22 -51.26 10.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.599 -179.7 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.444 ' HB3' ' HB3' ' A' ' 61' ' ' SER . 33.2 t -69.07 -44.65 72.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.686 -178.033 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.784 ' HG ' HD22 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -69.86 -62.14 1.5 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.986 -177.136 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.667 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -51.15 -29.28 13.13 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.962 -177.646 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.476 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.4 OUTLIER -69.59 -39.53 77.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.138 0.494 . . . . 0.0 110.233 178.013 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.442 ' HE3' ' OE2' ' A' ' 54' ' ' GLU . 5.0 mtmm -65.49 -61.05 2.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.236 178.862 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.529 ' CG1' HG23 ' A' ' 32' ' ' ILE . 53.0 t -61.78 -20.95 24.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.942 -179.416 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.603 ' O ' HG22 ' A' ' 73' ' ' VAL . 16.5 t70 -54.63 -51.76 64.39 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 176.458 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.497 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 0.5 OUTLIER -69.23 -26.3 64.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.017 177.003 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.686 ' O ' HG22 ' A' ' 75' ' ' VAL . . . -61.17 -48.2 82.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.04 179.952 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.603 HG22 ' O ' ' A' ' 70' ' ' ASP . 2.6 m -58.48 -31.58 43.66 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 177.541 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.497 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -68.16 -37.92 81.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.145 178.952 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.686 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -60.61 -31.17 48.38 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.217 0 CA-C-O 120.919 0.39 . . . . 0.0 110.225 179.511 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.681 ' HG ' ' HB3' ' A' ' 39' ' ' LEU . 2.3 tm? -71.41 -49.54 40.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.215 178.803 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 9.7 mm100 -57.62 -37.64 73.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.457 179.214 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.29 -21.78 39.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.905 -0.588 . . . . 0.0 111.067 179.293 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.504 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 11.9 t-80 -59.74 -53.13 61.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.025 -179.534 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -73.7 -7.03 50.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.088 -179.812 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.67 -54.76 5.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.49 -179.592 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 5.5 mmtp -78.6 -23.82 45.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.41 -178.975 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.504 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 1.5 tt0 -77.09 -34.98 56.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.19 -179.575 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -72.46 -27.42 62.29 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.075 -179.779 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.22 -72.05 0.17 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.061 179.928 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -87.83 133.37 33.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.918 179.934 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.87 57.21 2.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.842 179.976 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -81.39 6.5 14.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.104 179.864 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -97.89 169.66 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.962 179.844 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.82 37.36 1.3 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.951 -179.937 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.5 p -77.46 -10.13 59.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.942 -179.993 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.01 165.68 24.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.024 179.839 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -95.25 -35.21 11.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.942 179.981 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -104.66 96.13 1.21 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.547 -179.809 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 12.5 t -93.41 118.89 67.7 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 120.598 0.237 . . . . 0.0 111.032 -179.942 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -57.95 147.77 80.1 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.53 2.154 . . . . 0.0 112.139 179.913 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -81.98 153.82 26.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.904 -179.908 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.6 m . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.105 -0.95 . . . . 0.0 111.141 179.924 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 17.2 m . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.829 0.347 . . . . 0.0 110.992 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 23.8 m -90.12 -178.69 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.155 -179.89 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 2.5 pttp -85.71 146.32 26.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.953 -179.901 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 4' ' ' SER . . . . . 0.445 ' HB2' ' HB2' ' B' ' 10' ' ' ALA . 7.6 t -87.32 -161.72 0.72 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.929 -179.822 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -103.57 -50.79 3.34 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.237 179.117 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.432 HD12 ' HA ' ' B' ' 6' ' ' LEU . 7.5 tp -68.87 -77.53 0.08 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.112 178.182 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 7' ' ' ASN . . . . . 0.463 ' HA ' ' HD3' ' B' ' 8' ' ' PRO . 1.4 t-20 -92.08 127.6 48.72 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.327 177.768 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 6.6 Cg_exo -73.77 -2.12 11.76 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.281 1.987 . . . . 0.0 112.177 -179.717 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 8.3 m-20 -123.76 40.31 3.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.042 -179.774 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 10' ' ' ALA . . . . . 0.615 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -53.1 92.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.508 -179.383 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.497 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -121.37 136.23 54.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.946 179.125 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -47.67 168.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -177.905 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 13' ' ' PHE . . . . . 0.803 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.6 OUTLIER -87.32 77.67 8.9 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.783 179.171 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' B' B ' 14' ' ' VAL . . . . . 0.879 ' H ' ' HD2' ' B' ' 15' ' ' PRO . 3.2 m -117.36 -33.19 0.08 OUTLIER Pre-proline 0 CA--C 1.54 0.595 0 N-CA-C 114.255 1.205 . . . . 0.0 114.255 -175.897 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 15' ' ' PRO . . . . . 0.879 ' HD2' ' H ' ' B' ' 14' ' ' VAL . 10.0 Cg_endo -52.4 -35.76 66.55 Favored 'Trans proline' 0 C--N 1.356 0.946 0 C-N-CA 121.772 1.648 . . . . 0.0 112.508 -178.672 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.52 -8.54 7.07 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.5 -179.767 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.687 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 27.5 m -108.49 -175.78 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.635 0.255 . . . . 0.0 110.627 179.822 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.644 ' HG3' HE22 ' A' ' 20' ' ' GLN . 1.8 mppt? -63.95 87.88 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.012 0.434 . . . . 0.0 110.556 179.804 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.497 ' CE2' ' HG2' ' B' ' 11' ' ' LYS . 0.2 OUTLIER -81.04 108.81 15.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.101 -178.922 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 90.5 47.31 3.79 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.445 -179.929 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 21' ' ' ASN . . . . . 0.424 ' O ' HD13 ' B' ' 22' ' ' ILE . 36.9 t30 -95.83 -30.66 13.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.892 0.377 . . . . 0.0 111.024 -179.798 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 22' ' ' ILE . . . . . 0.424 HD13 ' O ' ' B' ' 21' ' ' ASN . 17.6 mm . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.191 -0.909 . . . . 0.0 110.994 179.854 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.232 0 N-CA-C 112.409 -0.276 . . . . 0.0 112.409 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -59.63 94.97 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.575 2.183 . . . . 0.0 112.269 -179.838 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.2 tt -86.35 115.59 23.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.752 179.634 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.18 104.46 1.93 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.69 -0.766 . . . . 0.0 112.512 -179.724 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 70.7 m -81.61 111.38 25.27 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 120.595 0.236 . . . . 0.0 110.868 179.934 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.579 ' HG2' ' N ' ' A' ' 10' ' ' SER . 35.3 Cg_endo -65.42 -170.36 0.16 Allowed 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.602 2.202 . . . . 0.0 112.445 -179.769 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.448 ' O ' ' HG3' ' A' ' 11' ' ' MET . 22.3 mt -91.21 -78.12 0.4 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.227 -179.447 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.761 HG21 ' HB3' ' A' ' 29' ' ' PHE . 9.9 t -87.9 -31.28 19.55 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.559 -179.157 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.509 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.18 -36.57 75.56 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 177.175 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.579 ' N ' ' HG2' ' A' ' 6' ' ' PRO . 35.2 t -71.4 -34.19 70.15 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.625 177.003 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.736 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 5.3 mtm -64.32 -34.31 77.84 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 177.347 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.633 HD11 ' HB3' ' A' ' 24' ' ' LEU . 3.4 mp -52.54 -52.61 53.97 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.902 178.481 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.09 -25.51 67.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.895 178.414 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.6 p -101.93 13.23 35.37 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.846 -178.676 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.777 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -134.33 57.85 26.29 Favored Pre-proline 0 CA--C 1.534 0.339 0 CA-C-O 120.528 0.204 . . . . 0.0 111.29 -179.871 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.514 ' HD3' ' N ' ' A' ' 15' ' ' ALA . 49.4 Cg_exo -58.47 -49.22 12.61 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 122.725 2.283 . . . . 0.0 114.181 -178.272 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.48 ' HD2' ' N ' ' A' ' 16' ' ' PRO . 37.8 Cg_endo -66.22 -158.48 0.04 OUTLIER 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 122.063 1.842 . . . . 0.0 112.746 -178.283 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -73.67 64.68 0.93 Allowed 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.873 179.921 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.777 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -104.47 9.88 35.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.676 -179.933 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -47.07 -67.27 0.29 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.521 -179.14 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.81 ' HE3' ' HA ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER -55.79 -21.21 18.12 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.814 -177.706 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.59 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 10.3 tt0 -73.52 -78.32 0.1 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.006 0.431 . . . . 0.0 111.254 179.177 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.587 ' HE2' ' HB3' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -69.25 -95.99 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -176.909 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.649 ' HB2' ' HG2' ' A' ' 30' ' ' PRO . 0.3 OUTLIER -61.63 -1.32 0.56 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -175.323 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.597 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.38 -117.41 10.61 Favored Glycine 0 CA--C 1.505 -0.569 0 N-CA-C 108.262 -1.935 . . . . 0.0 108.262 -174.6 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.477 ' O ' HD22 ' A' ' 55' ' ' LEU . 0.6 OUTLIER -76.45 -67.59 0.68 Allowed 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 107.143 -1.428 . . . . 0.0 107.143 168.049 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.69 ' HB2' HD13 ' A' ' 55' ' ' LEU . 1.6 tpt180 -159.71 10.54 0.12 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 114.364 -1.289 . . . . 0.0 108.614 175.302 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.513 HD12 ' HA ' ' A' ' 44' ' ' THR . 3.8 mm? -56.91 -84.84 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.655 -1.157 . . . . 0.0 113.929 -172.924 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.761 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -31.14 -51.09 0.43 Allowed Pre-proline 0 CA--C 1.539 0.535 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -174.833 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.649 ' HG2' ' HB2' ' A' ' 24' ' ' LEU . 54.1 Cg_exo -56.43 -42.75 62.37 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 122.238 1.959 . . . . 0.0 113.875 -178.178 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.662 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.12 -44.06 66.38 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.112 0.482 . . . . 0.0 110.375 -178.232 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.73 HG21 HD12 ' A' ' 43' ' ' ILE . 0.0 OUTLIER -72.55 -20.64 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.708 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.127 179.254 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 62.8 tp60 -62.79 -31.45 72.43 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 175.684 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.33 -20.14 55.34 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 114.99 -1.004 . . . . 0.0 109.984 176.942 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.602 ' HG3' ' HA ' ' A' ' 32' ' ' ILE . 2.5 mtt -98.49 7.06 46.65 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.117 178.679 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -77.29 163.46 64.45 Favored Pre-proline 0 N--CA 1.447 -0.621 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.427 -179.75 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -100.85 90.05 0.08 OUTLIER 'Cis proline' 0 C--N 1.353 0.769 0 C-N-CA 124.535 -1.027 . . . . 0.0 113.49 4.078 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 6.5 m -98.99 -70.36 0.73 Allowed 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 176.163 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 1.035 HD23 HD12 ' A' ' 76' ' ' LEU . 2.9 tp -171.76 28.62 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.157 176.887 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -33.6 -38.96 0.05 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.046 -179.272 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.584 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -52.26 -53.0 33.3 Favored Glycine 0 C--N 1.33 0.238 0 C-N-CA 121.052 -0.594 . . . . 0.0 113.048 179.61 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.95 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -78.16 -34.14 49.9 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 122.676 -0.308 . . . . 0.0 111.427 -179.725 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.829 HD13 ' HA ' ' A' ' 73' ' ' VAL . 1.8 mt -54.14 -57.98 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-O 120.583 0.23 . . . . 0.0 110.789 179.979 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.513 ' HA ' HD12 ' A' ' 28' ' ' LEU . 10.0 t -47.76 -46.03 29.73 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.078 178.558 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.581 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -50.15 -66.49 2.32 Favored Glycine 0 N--CA 1.449 -0.462 0 CA-C-N 115.608 -0.724 . . . . 0.0 113.214 179.838 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.505 ' HB2' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.47 -51.68 66.14 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -177.648 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.486 HD12 ' HB2' ' B' ' 7' ' ' ASN . 2.8 mm? -79.35 8.33 6.33 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -177.975 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.581 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.13 -6.82 14.57 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.08 0.467 . . . . 0.0 110.334 178.676 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.471 ' OE2' ' HB3' ' B' ' 11' ' ' LYS . 3.3 mt-10 -81.66 16.06 1.91 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.607 178.698 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.84 HD11 ' NZ ' ' A' ' 68' ' ' LYS . 0.9 OUTLIER -83.18 160.25 3.58 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.633 -179.729 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.529 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 34.4 m-20 -70.99 154.98 41.36 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.97 0.414 . . . . 0.0 112.036 -178.16 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.833 ' HA ' HD23 ' A' ' 55' ' ' LEU . 2.4 t30 -82.99 -31.08 27.72 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.034 177.995 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.2 t -73.97 -33.46 63.87 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.344 0.592 . . . . 0.0 109.477 177.592 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.529 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -75.38 -27.82 59.25 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.467 179.074 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.833 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -59.64 -47.82 84.08 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.189 179.432 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.449 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 12.2 tp -56.54 -46.27 80.76 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.623 179.361 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -59.75 -32.67 70.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.28 179.882 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.539 ' SD ' ' HE2' ' A' ' 68' ' ' LYS . 32.0 mmt -60.87 -51.61 68.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.432 -179.4 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.585 ' HG ' ' NH2' ' A' ' 27' ' ' ARG . 0.2 OUTLIER -61.61 -22.23 65.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.081 -179.057 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 56' ' ' LEU . 2.2 mt-10 -99.75 -3.64 32.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.8 179.954 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.585 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 16.0 m -122.72 80.64 48.57 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.52 179.617 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.37 -35.69 95.97 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.147 1.898 . . . . 0.0 111.996 179.85 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.579 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.67 -45.19 21.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.718 -179.466 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.579 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 7.0 m -70.47 -51.98 25.27 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.952 0.406 . . . . 0.0 111.33 -178.079 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.626 ' HG ' ' N ' ' A' ' 66' ' ' ARG . 0.3 OUTLIER -58.12 -61.06 2.83 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.672 -178.755 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.626 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 1.1 ttp180 -48.39 -33.33 8.95 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.221 -177.436 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.443 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 8.2 t -61.67 -44.23 97.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.118 0.485 . . . . 0.0 110.277 178.307 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.84 ' NZ ' HD11 ' A' ' 50' ' ' ILE . 13.6 mtpp -65.92 -63.03 1.18 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.806 179.451 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.593 ' CG1' HG23 ' A' ' 32' ' ' ILE . 55.2 t -58.77 -19.45 14.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.089 -179.496 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.59 ' O ' HG22 ' A' ' 73' ' ' VAL . 20.4 t70 -58.19 -48.89 78.91 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 175.709 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.47 ' HB3' HD13 ' B' ' 6' ' ' LEU . 3.5 tt0 -69.03 -27.23 65.48 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.817 176.603 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.598 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -60.31 -54.39 46.31 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.178 179.485 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.829 ' HA ' HD13 ' A' ' 43' ' ' ILE . 3.3 m -55.08 -29.62 22.65 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 177.932 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.432 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -73.57 -36.37 65.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.618 179.794 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.569 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.1 m -56.26 -31.17 31.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 N-CA-C 109.713 -0.476 . . . . 0.0 109.713 179.493 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 1.035 HD12 HD23 ' A' ' 39' ' ' LEU . 4.4 mm? -72.21 -48.69 41.08 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.861 176.552 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 34.9 mm-40 -50.82 -34.38 27.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.316 177.906 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -82.18 -29.7 31.35 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.55 176.911 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.576 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 16.4 t-80 -61.25 -42.24 98.28 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.979 -179.913 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -71.91 -25.45 61.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.964 0.411 . . . . 0.0 110.466 178.902 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -73.64 -45.18 54.33 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.629 179.242 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.559 ' HD3' ' HG3' ' B' ' 3' ' ' LYS . 0.0 OUTLIER -76.25 -19.43 58.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.23 178.788 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.576 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 8.0 tt0 -74.22 -48.58 27.95 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.123 178.689 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.03 -46.9 87.98 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 176.479 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -85.41 59.79 5.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.364 176.911 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.52 7.78 1.71 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.575 -178.21 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.68 110.36 7.91 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.478 179.368 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.32 85.34 0.4 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.284 -178.971 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.552 HG12 ' H ' ' A' ' 91' ' ' SER . 20.9 t -93.96 115.48 32.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.967 179.632 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -89.15 4.94 46.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.944 -179.738 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.552 ' H ' HG12 ' A' ' 89' ' ' VAL . 22.8 t -81.1 -20.79 40.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.937 179.98 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -91.79 111.23 22.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.026 179.984 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -115.08 154.63 28.54 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.953 -179.902 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -88.15 -158.96 34.07 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.494 -179.958 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.583 ' H ' ' HD2' ' A' ' 96' ' ' PRO . 18.6 t -105.2 -52.73 0.1 Allowed Pre-proline 0 C--N 1.329 -0.324 0 N-CA-C 111.607 0.225 . . . . 0.0 111.607 -179.701 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.583 ' HD2' ' H ' ' A' ' 95' ' ' VAL . 71.8 Cg_endo -77.75 102.63 1.61 Allowed 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.154 1.903 . . . . 0.0 112.416 -179.853 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 60.3 p -105.56 133.18 50.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.895 179.85 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 16.5 m . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.114 -0.946 . . . . 0.0 111.029 179.848 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 27.6 m . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.752 0.311 . . . . 0.0 111.042 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 15.5 m -88.56 172.49 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.149 -179.824 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 3' ' ' LYS . . . . . 0.559 ' HG3' ' HD3' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -76.19 79.28 2.99 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.753 179.746 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.35 154.07 18.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.4 -179.18 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -108.67 -48.79 3.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.433 179.08 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.47 HD13 ' HB3' ' A' ' 71' ' ' GLU . 1.9 tp -64.8 -83.19 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.472 178.949 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 7' ' ' ASN . . . . . 0.486 ' HB2' HD12 ' A' ' 47' ' ' LEU . 0.7 OUTLIER -82.47 113.06 41.67 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.441 178.301 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -66.41 -5.05 11.84 Favored 'Trans proline' 0 N--CA 1.463 -0.296 0 C-N-CA 122.122 1.882 . . . . 0.0 112.242 -179.728 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 69.0 m-20 -123.74 38.52 4.17 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.465 179.139 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 10' ' ' ALA . . . . . 0.505 ' HB1' ' HB2' ' A' ' 46' ' ' MET . . . -53.91 94.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.87 -178.641 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.584 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -115.01 131.59 56.87 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.839 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' B' B ' 12' ' ' GLU . . . . . 0.539 ' HG2' ' HD2' ' A' ' 42' ' ' LYS . 6.7 mt-10 -50.0 178.97 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -177.204 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 13' ' ' PHE . . . . . 0.46 ' CE1' ' HG ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -86.9 79.92 8.62 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.853 179.725 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' B' B ' 14' ' ' VAL . . . . . 0.516 ' H ' ' HD2' ' B' ' 15' ' ' PRO . 3.2 t -109.75 -49.94 0.07 OUTLIER Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 115.316 -0.857 . . . . 0.0 112.418 -177.319 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 15' ' ' PRO . . . . . 0.516 ' HD2' ' H ' ' B' ' 14' ' ' VAL . 97.5 Cg_exo -44.82 -44.07 14.62 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 122.392 2.061 . . . . 0.0 112.829 -179.058 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 81.11 -30.47 2.67 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.652 -0.785 . . . . 0.0 112.483 -179.99 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.81 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 2.1 m -94.66 -174.55 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.496 0.189 . . . . 0.0 110.619 179.495 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.428 ' HD3' ' H ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -59.28 89.4 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.075 0.464 . . . . 0.0 110.974 -178.68 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.584 ' CE2' ' HG2' ' B' ' 11' ' ' LYS . 2.1 t80 -85.63 105.7 16.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.067 -179.511 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 85.11 60.95 1.78 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.495 179.893 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -95.18 -8.91 34.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.727 0.299 . . . . 0.0 110.935 -179.809 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 24.1 mm . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.203 -0.903 . . . . 0.0 111.076 179.973 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.127 0 N-CA-C 112.509 -0.237 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_exo -56.56 -46.03 32.9 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.576 2.184 . . . . 0.0 112.323 -179.885 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -94.45 25.6 3.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.872 -179.961 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -81.53 -25.24 54.55 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.634 -179.868 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.98 112.65 31.68 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 120.589 0.233 . . . . 0.0 110.889 -179.947 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_exo -62.41 87.03 0.11 Allowed 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.583 2.189 . . . . 0.0 112.288 -179.908 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.45 ' O ' ' HG3' ' A' ' 11' ' ' MET . 3.3 mt -100.87 114.11 27.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.912 179.916 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.77 HG21 ' HB3' ' A' ' 29' ' ' PHE . 9.8 t -87.89 -34.15 18.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.435 -179.685 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.44 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.22 -36.23 75.05 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 177.068 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 5.4 t -68.98 -35.74 77.06 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.746 177.101 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.753 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 5.4 mtm -64.39 -35.92 82.46 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.943 177.769 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.813 HD11 ' HB3' ' A' ' 24' ' ' LEU . 4.2 mp -52.31 -48.48 65.37 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.07 178.921 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.97 -30.17 70.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.836 178.312 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.9 p -101.71 21.56 14.26 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.716 -179.012 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.622 ' HB1' ' CB ' ' A' ' 19' ' ' GLU . . . -134.51 59.13 34.16 Favored Pre-proline 0 CA--C 1.532 0.277 0 CA-C-O 120.555 0.217 . . . . 0.0 111.319 179.875 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.484 ' HD3' ' N ' ' A' ' 15' ' ' ALA . 52.5 Cg_exo -56.26 -49.35 15.46 Favored 'Trans proline' 0 CA--C 1.537 0.671 0 C-N-CA 122.631 2.221 . . . . 0.0 113.873 -178.706 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.479 ' HD3' ' HB2' ' A' ' 16' ' ' PRO . 23.7 Cg_exo -65.31 -162.7 0.05 OUTLIER 'Trans proline' 0 C--N 1.354 0.853 0 C-N-CA 122.272 1.981 . . . . 0.0 112.73 -178.488 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -74.48 52.8 0.51 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.216 179.508 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.622 ' CB ' ' HB1' ' A' ' 15' ' ' ALA . 2.1 mm-40 -86.6 11.09 13.6 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.727 179.97 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.415 ' O ' HD23 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -46.04 -70.1 0.11 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.122 -179.078 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.515 ' H ' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -55.6 -18.59 7.99 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.651 -177.668 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.541 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 10.8 tp60 -73.95 -79.22 0.09 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.909 0.385 . . . . 0.0 111.457 178.223 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.698 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.17 -94.9 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.984 -0.553 . . . . 0.0 112.412 -176.775 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.813 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -59.45 0.52 0.12 Allowed 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -176.588 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.556 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.36 -118.85 13.69 Favored Glycine 0 CA--C 1.501 -0.84 0 N-CA-C 107.979 -2.048 . . . . 0.0 107.979 -174.384 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.542 ' CD ' HG22 ' A' ' 50' ' ' ILE . 29.0 mt-10 -77.26 -66.01 0.88 Allowed 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 167.659 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.825 ' HB2' HD13 ' A' ' 55' ' ' LEU . 2.5 tpt180 -160.22 9.51 0.1 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.095 -1.411 . . . . 0.0 108.472 174.76 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.94 HD12 ' HA ' ' A' ' 44' ' ' THR . 3.6 mm? -56.99 -80.42 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.732 -1.122 . . . . 0.0 113.681 -172.978 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.77 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -34.82 -48.71 1.01 Allowed Pre-proline 0 CA--C 1.538 0.505 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -174.445 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.665 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 50.5 Cg_exo -57.95 -42.85 54.1 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.15 1.9 . . . . 0.0 113.573 -178.972 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.604 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.86 -47.4 53.26 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.664 -178.328 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.639 ' HA ' ' HG3' ' A' ' 35' ' ' MET . 0.0 OUTLIER -69.76 -18.22 21.91 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 C-N-CA 120.614 -0.434 . . . . 0.0 109.938 178.86 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.478 ' HB3' ' O ' ' A' ' 30' ' ' PRO . 36.4 tp60 -62.88 -34.14 76.76 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 174.136 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -74.16 -19.12 60.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 114.775 -1.102 . . . . 0.0 110.128 176.816 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.639 ' HG3' ' HA ' ' A' ' 32' ' ' ILE . 0.1 OUTLIER -98.66 -3.42 36.08 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.892 178.22 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.435 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -62.51 166.05 7.98 Favored Pre-proline 0 N--CA 1.448 -0.568 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.247 -179.951 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.405 ' HA ' ' CB ' ' A' ' 36' ' ' HIS . 69.6 Cg_endo -103.7 61.3 0.62 Allowed 'Cis proline' 0 N--CA 1.455 -0.747 0 C-N-CA 124.69 -0.962 . . . . 0.0 113.959 5.158 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 52.7 m -77.04 -73.8 0.28 Allowed 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 176.793 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.584 HD13 HD11 ' A' ' 76' ' ' LEU . 0.2 OUTLIER -171.95 49.5 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.848 176.428 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.504 ' CB ' ' HB ' ' A' ' 32' ' ' ILE . . . -41.47 -34.63 0.57 Allowed 'General case' 0 N--CA 1.462 0.13 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.582 179.907 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -54.3 -71.99 0.62 Allowed Glycine 0 N--CA 1.452 -0.28 0 CA-C-N 116.083 -0.508 . . . . 0.0 113.692 -179.207 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.541 ' O ' ' HG2' ' A' ' 46' ' ' MET . 0.0 OUTLIER -57.57 -41.85 81.91 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -177.074 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.641 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 22.7 mt -53.31 -57.4 4.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 121.079 0.466 . . . . 0.0 110.195 179.262 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.94 ' HA ' HD12 ' A' ' 28' ' ' LEU . 1.3 m -47.64 -45.78 28.19 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.247 177.475 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.744 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -51.25 -60.7 6.92 Favored Glycine 0 N--CA 1.445 -0.71 0 CA-C-N 115.06 -0.973 . . . . 0.0 113.231 -179.623 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.622 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -54.41 -59.47 4.65 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.746 0.307 . . . . 0.0 111.779 -177.473 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.793 HD23 ' HB2' ' B' ' 7' ' ' ASN . 1.1 mp -79.9 18.23 0.84 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.162 0.431 . . . . 0.0 112.162 -176.742 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.599 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.01 -6.94 14.42 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.301 0.572 . . . . 0.0 109.582 175.659 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.515 ' OE1' ' HB3' ' B' ' 9' ' ' ASN . 2.6 mt-10 -93.24 25.35 3.37 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.756 179.462 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.542 HG22 ' CD ' ' A' ' 26' ' ' GLU . 3.5 tt -83.0 176.23 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.782 -179.72 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.745 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 7.0 m-20 -73.53 124.47 25.94 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.705 0.261 . . . . 0.0 111.705 179.441 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.673 ' HA ' HD23 ' A' ' 55' ' ' LEU . 7.2 t30 -66.14 -30.54 71.05 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.448 0.642 . . . . 0.0 109.722 177.521 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.6 m -73.31 -33.19 65.03 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.838 177.612 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.745 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 3.9 mm-40 -76.96 -24.4 52.31 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.449 178.81 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.825 HD13 ' HB2' ' A' ' 27' ' ' ARG . 0.6 OUTLIER -59.08 -47.93 83.46 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 179.515 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.44 HD22 ' HA ' ' A' ' 56' ' ' LEU . 0.3 OUTLIER -59.45 -42.33 91.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.779 178.174 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.531 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 26.6 m-70 -69.27 -19.03 63.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.243 179.321 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.551 ' HG2' ' O ' ' A' ' 54' ' ' GLU . 23.8 mmt -68.66 -58.97 3.48 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.053 -179.576 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.698 HD13 ' NE ' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -61.51 -21.02 63.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.103 -179.577 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.531 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 0.6 OUTLIER -91.62 -9.57 43.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.085 179.817 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.552 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.5 OUTLIER -122.92 85.25 50.41 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.799 179.696 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_exo -59.88 -33.52 95.85 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.398 2.065 . . . . 0.0 112.292 -179.666 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.636 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.22 -45.8 22.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.297 -179.395 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.636 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 10.7 m -70.62 -54.16 13.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.83 0.348 . . . . 0.0 111.328 -178.695 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.632 ' HG ' ' N ' ' A' ' 66' ' ' ARG . 0.3 OUTLIER -57.82 -61.99 2.13 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.866 -178.286 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.632 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -48.53 -35.29 12.92 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.055 -177.256 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.15 -44.01 97.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.155 0.502 . . . . 0.0 110.154 178.45 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.514 ' HZ1' HD11 ' A' ' 50' ' ' ILE . 29.4 mtpt -66.3 -62.21 1.6 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.114 179.619 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.514 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 45.4 t -59.8 -21.29 21.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.187 -178.871 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.598 ' O ' HG22 ' A' ' 73' ' ' VAL . 18.5 t70 -58.34 -48.52 80.31 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 176.412 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.513 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 0.8 OUTLIER -69.04 -25.61 64.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.597 176.557 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.641 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -62.2 -53.15 59.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.015 -179.908 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.598 HG22 ' O ' ' A' ' 70' ' ' ASP . 11.1 m -57.41 -26.28 26.0 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 177.684 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.513 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -73.18 -36.84 66.64 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.187 178.618 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.564 HG13 ' HA ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.04 -37.65 62.71 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.147 0 CA-C-O 120.896 0.379 . . . . 0.0 110.051 179.458 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.584 HD11 HD13 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -71.8 -43.11 66.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.081 177.961 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 54.7 mm-40 -52.85 -38.51 61.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.732 178.624 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.69 -26.02 35.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.302 177.151 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.515 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 18.2 t60 -68.06 -32.17 72.33 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.039 -179.886 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -83.28 -11.25 57.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.006 -179.959 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -76.36 -63.33 1.36 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.184 -179.656 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 29.8 mttt -68.65 -14.11 62.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.14 -179.561 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.515 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 10.9 tt0 -91.12 -19.87 22.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.92 0.391 . . . . 0.0 110.807 179.6 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -68.5 -9.75 51.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.068 179.809 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.62 -43.67 96.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.962 179.949 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -83.5 -68.51 0.7 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.833 179.7 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -94.83 124.88 39.13 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.922 179.793 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -81.8 79.4 8.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.08 179.995 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -103.9 6.87 10.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.986 179.862 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -74.24 -60.47 2.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.041 -179.89 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 10.3 t -77.08 -15.03 59.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.833 -179.932 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -80.9 149.22 29.53 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.046 179.911 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -116.83 167.51 11.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.927 -179.838 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -92.99 -67.26 1.09 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.468 -179.982 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 3.2 t -84.88 125.43 70.81 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 120.586 0.231 . . . . 0.0 110.981 179.949 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -65.39 -60.18 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.476 2.118 . . . . 0.0 112.268 -179.92 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 81.7 p -90.33 154.66 19.53 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.9 -179.852 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.149 -0.929 . . . . 0.0 111.042 179.879 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 2.0 t . . . . . 0 N--CA 1.487 1.392 0 CA-C-O 120.833 0.349 . . . . 0.0 110.969 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.5 p -89.12 142.63 12.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.021 -179.764 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.64 143.64 26.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.911 179.997 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 18.0 t -78.13 -176.09 4.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.717 179.73 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -103.9 -55.91 2.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.896 -179.742 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.452 HD11 ' HG2' ' A' ' 68' ' ' LYS . 0.4 OUTLIER -62.7 -80.89 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.622 179.532 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' B' B ' 7' ' ' ASN . . . . . 0.793 ' HB2' HD23 ' A' ' 47' ' ' LEU . 1.4 t-20 -87.02 117.43 68.62 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.831 179.193 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -73.77 6.37 2.89 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.314 2.01 . . . . 0.0 111.957 179.619 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 9' ' ' ASN . . . . . 0.515 ' HB3' ' OE1' ' A' ' 49' ' ' GLU . 71.5 m-20 -123.08 38.73 4.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.83 179.92 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 10' ' ' ALA . . . . . 0.622 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -59.37 88.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.961 -179.189 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.471 ' HG3' ' CD ' ' A' ' 49' ' ' GLU . 12.8 mttp -112.73 123.36 50.12 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 177.553 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -47.19 171.11 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -176.668 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 13' ' ' PHE . . . . . 0.744 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.2 OUTLIER -86.99 93.57 9.39 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.714 179.529 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' B' B ' 14' ' ' VAL . . . . . 0.854 ' H ' ' HD2' ' B' ' 15' ' ' PRO . 17.1 t -124.3 -54.66 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.366 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -176.955 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 15' ' ' PRO . . . . . 0.854 ' HD2' ' H ' ' B' ' 14' ' ' VAL . 9.3 Cg_endo -51.68 -34.33 53.05 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 122.415 2.077 . . . . 0.0 112.597 -178.609 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 16' ' ' GLY . . . . . 0.484 ' O ' ' HB2' ' A' ' 21' ' ' LYS . . . 78.46 -18.55 5.48 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.314 -179.446 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.408 ' HA ' ' CD ' ' A' ' 21' ' ' LYS . 20.9 m -96.99 -171.12 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.514 0.197 . . . . 0.0 110.629 179.417 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 33.2 mttt -59.67 96.55 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.9 0.381 . . . . 0.0 110.571 -179.806 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.458 ' CE1' ' HG3' ' B' ' 15' ' ' PRO . 0.1 OUTLIER -85.31 98.09 10.33 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.047 -179.166 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 79.62 100.68 0.27 Allowed Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.436 -179.928 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 22.9 t30 -88.96 -16.95 30.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.767 0.318 . . . . 0.0 110.972 179.981 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.248 0.995 0 CA-C-O 118.262 -0.875 . . . . 0.0 111.05 179.985 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.201 0 CA-C-O 120.079 -0.289 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -76.24 152.38 96.19 Favored 'Cis proline' 0 C--N 1.348 0.525 0 C-N-CA 123.462 -1.474 . . . . 0.0 112.361 0.183 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.72 10.63 10.82 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.905 179.945 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -79.19 -15.29 80.57 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.571 179.966 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.644 ' HB2' ' HD3' ' A' ' 6' ' ' PRO . 23.5 m -95.24 -51.45 0.24 Allowed Pre-proline 0 CA--C 1.533 0.301 0 N-CA-C 111.469 0.174 . . . . 0.0 111.469 -179.757 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.644 ' HD3' ' HB2' ' A' ' 5' ' ' SER . 37.9 Cg_exo -60.77 91.76 0.09 OUTLIER 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 122.24 1.96 . . . . 0.0 112.358 -179.737 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.494 ' HB2' HE22 ' A' ' 33' ' ' GLN . 0.7 OUTLIER -100.98 -100.47 0.25 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.069 -179.951 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.798 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 11.7 t -88.09 -30.32 19.96 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.339 -179.776 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.68 -36.4 74.13 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 177.107 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.2 -36.26 71.84 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.785 177.341 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.798 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.4 mtm -64.45 -38.51 91.28 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.383 178.527 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.587 ' HA ' ' HE2' ' A' ' 23' ' ' MET . 50.9 mt -52.45 -49.39 64.71 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.16 179.516 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.41 -32.38 73.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.184 178.233 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.78 27.72 6.23 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.81 -178.502 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.745 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -138.17 115.23 9.24 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.695 -0.229 . . . . 0.0 111.202 179.696 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_exo -55.82 168.03 1.95 Allowed 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.356 2.037 . . . . 0.0 111.589 178.845 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.606 ' O ' ' HG3' ' A' ' 20' ' ' GLN . 52.0 Cg_exo -53.96 -40.74 79.77 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.258 1.972 . . . . 0.0 112.252 -179.728 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -74.21 4.99 4.87 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.76 -179.546 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.745 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 2.7 tp10 -102.04 14.06 33.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.611 0.243 . . . . 0.0 111.346 -179.208 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.606 ' HG3' ' O ' ' A' ' 17' ' ' PRO . 0.0 OUTLIER -54.41 -56.95 13.45 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.494 -178.86 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.602 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -55.94 -20.38 15.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.642 -177.963 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.434 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 12.0 tt0 -73.0 -79.04 0.08 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.956 0.408 . . . . 0.0 111.453 179.533 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.601 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.93 -94.32 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -176.684 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.601 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -61.46 3.34 0.13 Allowed 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 -174.705 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.74 -117.78 11.18 Favored Glycine 0 N--CA 1.444 -0.778 0 N-CA-C 108.214 -1.954 . . . . 0.0 108.214 -174.475 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 51' ' ' ASP . 1.3 mp0 -76.07 -67.55 0.67 Allowed 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 168.987 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.715 ' NE ' HD22 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -160.5 8.97 0.09 Allowed 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 114.258 -1.337 . . . . 0.0 108.086 176.466 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.904 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.3 OUTLIER -59.66 -73.85 0.08 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.316 -1.311 . . . . 0.0 114.051 -173.889 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.579 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -35.27 -48.45 1.15 Allowed Pre-proline 0 CA--C 1.541 0.596 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -175.42 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.599 ' HB2' ' NH1' ' A' ' 27' ' ' ARG . 45.1 Cg_exo -59.65 -41.96 51.24 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.372 2.048 . . . . 0.0 113.387 -178.601 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.946 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.33 -47.29 61.73 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 120.478 -0.489 . . . . 0.0 109.87 -178.957 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.488 HG13 ' O ' ' A' ' 28' ' ' LEU . 0.3 OUTLIER -73.3 -13.69 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.652 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.096 178.505 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.623 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 4.3 tp60 -61.33 -41.7 97.46 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 177.531 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.25 -28.8 67.53 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.124 175.13 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 35' ' ' MET . . . . . 0.558 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 5.5 mtt -102.01 27.42 6.6 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.345 178.393 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.623 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -63.79 -31.59 6.62 Favored Pre-proline 0 CA--C 1.537 0.468 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -177.083 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.601 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 54.9 Cg_exo -34.63 -34.32 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.255 0 C-N-CA 122.25 1.967 . . . . 0.0 112.406 179.33 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.608 HG22 HD12 ' A' ' 76' ' ' LEU . 23.5 m -78.6 -88.08 0.06 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.79 176.638 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.436 ' CB ' ' HG ' ' A' ' 76' ' ' LEU . 0.1 OUTLIER -171.34 62.47 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.408 178.14 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.478 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -43.81 -41.14 4.84 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.653 179.586 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.579 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -50.87 -53.61 25.68 Favored Glycine 0 C--N 1.33 0.22 0 CA-C-N 116.02 -0.536 . . . . 0.0 113.807 -178.692 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.508 ' HE2' ' SD ' ' A' ' 46' ' ' MET . 0.4 OUTLIER -77.43 -39.09 48.08 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.826 0.313 . . . . 0.0 111.764 -177.969 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.621 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 31.2 mt -53.86 -56.97 6.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.5 0.19 . . . . 0.0 110.972 -179.19 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.904 ' HA ' HD22 ' A' ' 28' ' ' LEU . 10.0 t -50.76 -42.26 57.54 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.811 0.339 . . . . 0.0 110.418 178.808 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.657 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -50.62 -67.93 1.69 Allowed Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 115.953 -0.567 . . . . 0.0 112.981 -179.761 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.508 ' SD ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.29 -46.37 76.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.789 0.295 . . . . 0.0 111.664 -178.723 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.418 HD22 ' N ' ' A' ' 47' ' ' LEU . 3.2 mm? -80.18 6.52 11.52 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 111.537 0.199 . . . . 0.0 111.537 -179.166 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.657 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.1 OUTLIER -65.81 -10.74 40.46 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.064 0.459 . . . . 0.0 110.372 179.558 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.494 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.5 mm-40 -79.23 18.43 0.68 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.415 177.831 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.629 HD11 ' HE3' ' A' ' 68' ' ' LYS . 1.3 tt -83.3 160.75 3.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.175 -179.381 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.471 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 17.7 m-20 -71.15 160.29 33.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.938 -178.837 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.734 ' HA ' HD23 ' A' ' 55' ' ' LEU . 5.8 m120 -87.69 -29.61 20.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.995 177.349 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 67.9 m -72.72 -33.05 66.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.897 178.12 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.467 ' HG3' ' HB2' ' A' ' 51' ' ' ASP . 14.8 mt-10 -75.83 -28.05 58.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.612 179.041 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.734 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.4 OUTLIER -59.64 -48.81 80.18 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.303 179.597 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.481 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 1.1 tm? -61.43 -37.0 81.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.409 179.322 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.518 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 4.8 m-70 -64.52 -35.98 82.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.259 178.428 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.586 ' HB3' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -66.01 -41.94 90.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.411 178.702 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.715 HD22 ' NE ' ' A' ' 27' ' ' ARG . 3.4 tp -69.69 -14.67 62.92 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.884 179.475 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.518 ' HG2' ' O ' ' A' ' 57' ' ' HIS . 5.0 pt-20 -106.77 -3.26 20.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.818 179.282 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.572 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 4.6 m -124.39 84.74 56.29 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.968 -179.548 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -60.35 -35.03 92.8 Favored 'Trans proline' 0 N--CA 1.464 -0.255 0 C-N-CA 122.214 1.943 . . . . 0.0 112.094 179.517 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.46 ' O ' ' HB2' ' A' ' 67' ' ' SER . 0.0 OUTLIER -78.81 -44.89 22.11 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.768 -179.419 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.551 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 12.8 m -74.22 -50.44 19.11 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.827 0.346 . . . . 0.0 111.539 -177.996 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.946 HD21 HD13 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -58.16 -64.96 0.73 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.118 -179.027 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.683 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.6 OUTLIER -49.19 -33.87 13.38 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.793 0.33 . . . . 0.0 110.793 -178.801 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.595 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.6 OUTLIER -69.58 -37.03 76.8 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 121.057 0.456 . . . . 0.0 110.148 177.933 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.629 ' HE3' HD11 ' A' ' 50' ' ' ILE . 9.4 ttpt -65.76 -57.86 7.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.081 178.491 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.532 HG21 ' CD1' ' A' ' 31' ' ' LEU . 46.9 t -63.48 -19.28 23.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.781 178.925 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.667 ' O ' HG22 ' A' ' 73' ' ' VAL . 9.1 t70 -55.89 -49.59 72.99 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 176.708 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.474 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 0.7 OUTLIER -69.02 -25.74 64.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.768 176.731 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.621 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -62.15 -44.25 97.03 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.937 179.758 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.667 HG22 ' O ' ' A' ' 70' ' ' ASP . 2.5 m -61.06 -31.71 50.71 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 177.419 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.474 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -66.1 -38.5 88.38 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.039 178.946 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.587 HG22 ' O ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -58.72 -31.97 45.55 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.095 0 CA-C-O 121.001 0.429 . . . . 0.0 110.124 179.262 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.608 HD12 HG22 ' A' ' 38' ' ' THR . 2.4 tm? -70.97 -46.77 61.77 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.943 178.177 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -52.86 -37.05 59.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.405 179.212 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.21 -22.61 38.69 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.844 178.819 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.544 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 20.4 t-80 -65.37 -36.77 84.99 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.714 179.598 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -82.84 0.68 42.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.149 -179.662 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -72.84 -70.88 0.33 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.155 -179.866 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.504 ' HD2' HG11 ' B' ' 1' ' ' VAL . 0.1 OUTLIER -72.5 -17.33 61.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.991 -179.842 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.544 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -86.99 -2.85 58.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.98 -179.981 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -73.87 16.0 0.25 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.729 178.693 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.466 ' H ' ' C ' ' A' ' 83' ' ' GLU . . . -63.3 114.28 3.72 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.955 -179.782 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.28 -167.37 0.41 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.896 -179.786 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.15 -172.67 1.44 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.83 -179.812 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -74.61 81.75 2.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.065 -179.897 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -100.59 15.85 4.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.892 179.883 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -86.7 14.71 6.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.912 -179.948 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.465 ' HB3' ' H ' ' A' ' 92' ' ' ALA . 3.5 m -77.93 -158.43 0.12 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.72 179.828 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.465 ' H ' ' HB3' ' A' ' 91' ' ' SER . . . -83.92 60.56 5.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.988 179.981 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 66.2 p -115.48 173.65 6.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.867 179.928 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -85.02 68.18 3.54 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.473 179.858 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 3.8 p -95.51 128.15 39.22 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 120.647 0.261 . . . . 0.0 110.99 179.977 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -72.35 95.73 0.78 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.457 2.105 . . . . 0.0 112.282 -179.879 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.2 p -91.66 39.21 1.0 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.918 179.999 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.1 t . . . . . 0 C--O 1.249 1.027 0 CA-C-O 117.967 -1.016 . . . . 0.0 111.073 179.98 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' B' B ' 1' ' ' VAL . . . . . 0.504 HG11 ' HD2' ' A' ' 82' ' ' LYS . 0.3 OUTLIER . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 120.894 0.378 . . . . 0.0 110.94 . . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -94.64 91.15 2.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.889 179.87 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.87 81.73 4.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.937 -179.815 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 4' ' ' SER . . . . . 0.401 ' HB2' ' HB2' ' B' ' 10' ' ' ALA . 45.3 t -86.61 160.99 18.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.743 179.869 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -104.28 -46.71 4.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.886 179.894 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 5.7 mt -69.66 -78.59 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.683 179.706 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 7' ' ' ASN . . . . . 0.483 ' HA ' ' HD3' ' B' ' 8' ' ' PRO . 1.5 t-20 -82.1 127.95 69.82 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.951 179.494 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.483 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 2.9 Cg_exo -76.96 -6.06 16.4 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.525 2.15 . . . . 0.0 111.948 179.249 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -123.12 56.65 1.16 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.945 179.963 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 10' ' ' ALA . . . . . 0.401 ' HB2' ' HB2' ' B' ' 4' ' ' SER . . . -60.26 96.73 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.567 179.955 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.494 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 0.7 OUTLIER -122.21 131.21 53.82 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.499 178.785 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -49.31 171.83 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.068 0.461 . . . . 0.0 112.087 -178.787 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 13' ' ' PHE . . . . . 0.465 ' CE1' ' HG ' ' A' ' 48' ' ' LEU . 0.3 OUTLIER -87.34 90.18 8.27 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.03 179.498 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' B' B ' 14' ' ' VAL . . . . . 0.88 HG23 ' HD3' ' B' ' 15' ' ' PRO . 0.5 OUTLIER -130.33 -37.51 0.03 OUTLIER Pre-proline 0 C--N 1.323 -0.583 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 -176.669 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' B' B ' 15' ' ' PRO . . . . . 0.88 ' HD3' HG23 ' B' ' 14' ' ' VAL . 83.6 Cg_exo -46.8 -38.19 22.53 Favored 'Trans proline' 0 C--N 1.357 1.023 0 C-N-CA 121.818 1.679 . . . . 0.0 112.711 -179.004 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 16' ' ' GLY . . . . . 0.481 ' O ' ' HD2' ' A' ' 21' ' ' LYS . . . 80.64 -25.23 3.44 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.498 -179.906 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -98.32 -176.65 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.611 0.243 . . . . 0.0 110.846 179.636 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.602 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -60.52 90.63 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.944 0.402 . . . . 0.0 110.815 -179.888 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.48 ' CG ' ' HG2' ' B' ' 15' ' ' PRO . 0.5 OUTLIER -84.05 120.3 25.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.893 -179.743 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 87.73 38.33 7.58 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.364 -179.56 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 21.8 p30 -84.63 175.2 9.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.766 0.317 . . . . 0.0 110.885 -179.918 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.195 -0.907 . . . . 0.0 111.065 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.829 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 9.0 t . . . . . 0 N--CA 1.455 -0.192 0 CA-C-O 120.668 0.271 . . . . 0.0 110.355 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.42 -37.77 78.93 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 176.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 42.5 t -69.44 -35.08 75.33 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.683 177.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.829 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.2 mtm -64.41 -38.61 91.65 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.117 178.223 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.754 HD21 ' HB3' ' A' ' 24' ' ' LEU . 46.1 mt -52.42 -49.31 64.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.211 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.55 -30.53 70.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.146 178.057 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.5 p -101.44 17.92 21.46 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.763 -178.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.613 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.067 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.613 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.4 OUTLIER . . . . . 0 N--CA 1.457 -0.093 0 CA-C-O 120.741 0.305 . . . . 0.0 111.023 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.698 HE22 ' HB3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -51.52 -63.56 1.1 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.13 179.76 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.617 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -55.97 -19.55 12.87 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.643 -178.239 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.551 ' N ' ' HE2' ' A' ' 21' ' ' LYS . 24.1 tt0 -73.61 -80.48 0.07 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.085 0.469 . . . . 0.0 111.465 179.039 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . 0.681 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.8 -95.24 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.816 -176.807 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.853 HD12 ' HD3' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -60.47 -1.37 0.35 Allowed 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -175.522 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.589 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.76 -116.04 8.52 Favored Glycine 0 N--CA 1.446 -0.68 0 N-CA-C 108.423 -1.871 . . . . 0.0 108.423 -174.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.97 -69.4 0.5 Allowed 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 168.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.853 ' HD3' HD12 ' A' ' 24' ' ' LEU . 0.5 OUTLIER -160.06 9.99 0.11 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.226 -1.352 . . . . 0.0 108.002 175.007 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.998 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.41 -74.88 0.06 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.146 -1.388 . . . . 0.0 114.012 -173.456 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.6 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -34.54 -49.2 0.97 Allowed Pre-proline 0 CA--C 1.537 0.465 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -175.754 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.599 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 52.1 Cg_exo -57.68 -44.68 39.14 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.297 1.998 . . . . 0.0 113.424 -179.025 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.595 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.75 -44.07 67.54 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.178 -178.371 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.832 HD11 HD23 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -76.19 -12.72 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.13 178.021 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.633 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 3.2 tp60 -62.58 -37.41 86.09 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 176.37 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.78 -32.39 72.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.25 -0.887 . . . . 0.0 108.934 174.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . 0.512 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 7.3 mtt -100.34 27.96 5.33 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.221 177.842 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.633 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 2.1 p-80 -63.77 -32.61 8.2 Favored Pre-proline 0 CA--C 1.536 0.442 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -177.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.544 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 62.0 Cg_exo -38.24 -28.57 0.12 Allowed 'Trans proline' 0 C--N 1.362 1.244 0 C-N-CA 122.224 1.949 . . . . 0.0 112.229 179.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.732 HG21 HG13 ' A' ' 73' ' ' VAL . 7.1 m -78.08 -86.54 0.06 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.874 176.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.497 ' O ' HG13 ' A' ' 43' ' ' ILE . 2.6 tp -171.46 49.7 0.02 OUTLIER 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.065 178.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.439 ' CA ' HG13 ' A' ' 43' ' ' ILE . . . -32.5 -46.5 0.14 Allowed 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 112.262 0.468 . . . . 0.0 112.262 -178.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.6 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -44.72 -59.12 4.45 Favored Glycine 0 C--N 1.33 0.216 0 CA-C-N 116.132 -0.485 . . . . 0.0 114.127 -178.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.739 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.5 OUTLIER -76.66 -27.08 55.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 117.032 0.416 . . . . 0.0 111.798 -177.646 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.775 HD12 HG21 ' A' ' 32' ' ' ILE . 0.9 OUTLIER -57.83 -56.34 16.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.735 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.998 ' HA ' HD22 ' A' ' 28' ' ' LEU . 12.3 t -50.54 -40.55 52.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.47 179.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.657 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -50.5 -68.41 1.46 Allowed Glycine 0 N--CA 1.451 -0.304 0 CA-C-N 115.913 -0.585 . . . . 0.0 113.28 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.655 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.61 -49.34 73.05 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 122.809 -0.23 . . . . 0.0 111.493 -178.365 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.535 HD12 ' HB2' ' B' ' 7' ' ' ASN . 2.3 mm? -79.94 9.62 5.17 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -178.366 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.627 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.96 -22.01 66.45 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.946 0.403 . . . . 0.0 110.606 179.276 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.565 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 3.4 mm-40 -74.63 21.72 0.11 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.062 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.47 ' H ' ' C ' ' A' ' 48' ' ' LEU . 2.6 tt -83.24 165.1 2.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.795 179.584 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.489 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 20.4 m-20 -70.79 156.38 39.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.862 0.363 . . . . 0.0 111.573 -179.109 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.864 ' HA ' HD23 ' A' ' 55' ' ' LEU . 5.1 m120 -88.9 -28.24 20.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.778 177.391 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.4 t -74.03 -30.18 62.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.664 177.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.489 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 4.9 mm-40 -80.11 -26.9 39.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.592 178.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.864 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.8 OUTLIER -59.16 -46.61 87.93 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.872 0.368 . . . . 0.0 110.052 179.636 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.438 HD22 ' HA ' ' A' ' 56' ' ' LEU . 0.2 OUTLIER -64.4 -41.31 96.72 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.468 179.19 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.523 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 7.0 t60 -64.5 -30.39 71.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.267 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.477 ' HB3' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -65.89 -45.24 82.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.869 -179.667 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.631 HD23 ' CG ' ' A' ' 27' ' ' ARG . 0.1 OUTLIER -66.38 -18.49 65.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.787 179.398 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.523 ' HG2' ' O ' ' A' ' 57' ' ' HIS . 4.1 pt-20 -100.14 -8.05 24.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.234 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.646 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.9 OUTLIER -125.38 88.1 54.68 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.946 179.737 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -60.06 -33.07 95.55 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.278 1.985 . . . . 0.0 112.23 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -78.0 -49.34 14.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.59 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 68.3 m -69.69 -32.24 70.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.888 0.375 . . . . 0.0 111.336 -178.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.646 ' HB3' ' O ' ' A' ' 61' ' ' SER . 1.1 tp -73.34 -65.23 0.84 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.598 -178.512 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.599 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -49.02 -29.67 5.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.186 -177.839 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.547 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.2 OUTLIER -65.43 -43.79 89.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.101 0.477 . . . . 0.0 110.286 178.292 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.452 ' HE3' HD11 ' A' ' 50' ' ' ILE . 22.1 mtpt -65.86 -55.86 14.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.626 179.208 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.507 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 53.2 t -65.01 -19.74 26.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.662 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.547 ' HB3' ' O ' ' A' ' 67' ' ' SER . 7.2 t70 -55.83 -48.52 75.3 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 176.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.48 ' O ' HG13 ' A' ' 75' ' ' VAL . 13.7 tt0 -67.06 -33.97 76.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.637 176.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.684 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -55.55 -44.73 77.06 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.651 178.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.732 HG13 HG21 ' A' ' 38' ' ' THR . 11.7 t -60.0 -32.49 50.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.936 177.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.43 -36.38 65.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.629 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.605 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.15 -28.84 35.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 120.922 0.391 . . . . 0.0 110.268 179.968 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.739 HD11 ' HB3' ' A' ' 42' ' ' LYS . 3.4 mm? -71.91 -54.32 10.39 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.802 178.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 25.5 mm100 -51.3 -36.63 43.35 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.469 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.48 -26.14 35.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.873 178.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 60.6 t60 . . . . . 0 C--N 1.331 -0.223 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.21 -179.423 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.756 0.312 . . . . 0.0 110.944 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.51 ' HB3' HD11 ' A' ' 47' ' ' LEU . 17.6 tp -68.94 -76.53 0.09 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.777 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' ASN . . . . . 0.682 HD22 ' H ' ' B' ' 9' ' ' ASN . 1.6 t30 -88.55 135.96 31.89 Favored Pre-proline 0 C--N 1.331 -0.197 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.856 179.38 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 5.7 Cg_exo -79.68 -3.65 13.01 Favored 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 122.73 2.287 . . . . 0.0 111.974 179.245 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 9' ' ' ASN . . . . . 0.682 ' H ' HD22 ' B' ' 7' ' ' ASN . 9.6 m-20 -123.16 51.09 1.48 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.174 -179.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . 0.655 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.23 93.69 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.746 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.565 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 3.0 mttp -124.94 154.08 41.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.376 178.521 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -54.51 166.12 0.48 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.808 0.337 . . . . 0.0 111.316 -179.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' PHE . . . . . 0.657 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.1 t80 . . . . . 0 C--N 1.331 -0.216 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.761 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.698 ' HB3' HE22 ' A' ' 20' ' ' GLN . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.846 0.355 . . . . 0.0 110.79 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 1.3 t80 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.957 -179.812 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.851 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 9.7 t . . . . . 0 N--CA 1.455 -0.177 0 CA-C-O 120.581 0.229 . . . . 0.0 110.404 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.99 -34.49 71.9 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 177.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.82 -35.72 70.01 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.608 177.151 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.851 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 3.6 mtm -64.6 -38.09 89.83 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.189 177.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.654 HD21 ' HB3' ' A' ' 24' ' ' LEU . 68.8 mt -52.69 -50.78 62.64 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.003 179.463 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.5 -26.6 67.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.715 177.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.43 18.12 20.94 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.645 -178.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.814 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 CA--C 1.532 0.283 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.994 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.814 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.9 OUTLIER . . . . . 0 N--CA 1.455 -0.202 0 CA-C-O 120.59 0.233 . . . . 0.0 111.029 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.576 HE22 ' HG2' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -46.86 -61.37 1.89 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.286 -178.96 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.576 ' HG2' HE22 ' A' ' 20' ' ' GLN . 0.0 OUTLIER -56.11 -25.11 44.57 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.685 -178.282 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.762 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 0.7 OUTLIER -73.26 -77.04 0.11 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.834 0.35 . . . . 0.0 111.627 179.921 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . 0.639 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -68.99 -95.91 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -176.483 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.654 ' HB3' HD21 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -61.9 -1.8 0.73 Allowed 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -175.515 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.533 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.8 -116.64 9.21 Favored Glycine 0 N--CA 1.446 -0.688 0 N-CA-C 108.535 -1.826 . . . . 0.0 108.535 -174.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.499 ' O ' HD13 ' A' ' 55' ' ' LEU . 0.9 OUTLIER -76.13 -69.97 0.47 Allowed 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 169.052 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.772 ' HG3' HD21 ' A' ' 31' ' ' LEU . 7.4 tpt180 -159.96 13.52 0.13 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.4 -1.273 . . . . 0.0 108.044 175.566 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.495 HD12 HD11 ' A' ' 32' ' ' ILE . 4.1 mm? -57.3 -78.85 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.406 -1.27 . . . . 0.0 113.574 -173.439 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.835 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -36.05 -49.58 1.61 Allowed Pre-proline 0 CA--C 1.537 0.469 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -175.676 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.58 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 55.0 Cg_exo -55.29 -43.05 62.45 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.25 1.966 . . . . 0.0 113.611 -178.407 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.869 HD22 ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -71.18 -48.44 51.67 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.065 0.459 . . . . 0.0 110.336 -178.493 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.495 HD11 HD12 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -71.87 -14.26 17.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.091 178.672 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.631 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.3 OUTLIER -62.24 -40.77 97.29 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 176.893 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.38 -30.51 71.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.166 174.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . 0.534 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 5.7 mtt -103.15 27.2 7.4 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.394 178.48 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.631 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 2.4 p-80 -62.92 -32.55 9.05 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -177.486 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.579 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 57.2 Cg_exo -36.0 -32.94 0.11 Allowed 'Trans proline' 0 C--N 1.362 1.266 0 C-N-CA 122.221 1.948 . . . . 0.0 112.199 179.014 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 62.6 m -78.18 -88.38 0.05 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.83 176.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.503 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.1 OUTLIER -171.31 61.06 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.513 178.324 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.481 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -47.02 -31.99 3.65 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.838 0.351 . . . . 0.0 111.508 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.643 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -43.24 -68.38 0.81 Allowed Glycine 0 CA--C 1.519 0.315 0 CA-C-N 115.697 -0.683 . . . . 0.0 114.597 -178.178 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.73 ' NZ ' ' HA ' ' B' ' 12' ' ' GLU . 0.7 OUTLIER -77.58 -29.16 51.92 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -176.809 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.649 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 37.6 mt -53.75 -52.16 37.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 121.157 -0.217 . . . . 0.0 111.378 -178.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.556 HG22 ' O ' ' A' ' 41' ' ' GLY . 5.6 t -48.17 -45.73 33.89 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.98 0.419 . . . . 0.0 110.293 178.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.714 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -52.07 -60.48 7.56 Favored Glycine 0 N--CA 1.453 -0.232 0 CA-C-N 115.623 -0.717 . . . . 0.0 113.76 -179.512 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.628 ' SD ' ' HE3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.74 -52.85 62.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.703 0.252 . . . . 0.0 111.52 -178.215 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.528 HD12 ' HB2' ' B' ' 7' ' ' ASN . 1.7 mm? -80.32 7.94 8.52 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -178.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.494 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.08 -15.15 62.83 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.922 0.391 . . . . 0.0 110.573 179.423 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.415 ' HB2' ' ND2' ' B' ' 7' ' ' ASN . 1.8 mm-40 -79.59 20.49 0.57 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.842 179.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.467 HG22 ' HG2' ' A' ' 26' ' ' GLU . 0.2 OUTLIER -83.43 161.43 3.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.745 -179.942 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.449 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 3.5 m-20 -68.27 157.06 36.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.821 -178.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.916 ' HA ' HD23 ' A' ' 55' ' ' LEU . 6.2 m120 -82.4 -31.42 29.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.149 178.037 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.477 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 1.0 OUTLIER -74.08 -30.86 62.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.348 0.594 . . . . 0.0 109.783 177.613 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.583 ' O ' ' HG2' ' A' ' 58' ' ' MET . 0.0 OUTLIER -78.77 -26.11 44.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.431 178.904 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.916 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -61.42 -49.51 76.58 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.674 -179.885 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.578 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 1.2 pp -62.81 -39.02 92.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.956 0.407 . . . . 0.0 110.69 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.646 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 13.2 t60 -62.37 -20.38 64.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.959 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.614 ' HB3' ' HG ' ' A' ' 65' ' ' LEU . 24.9 mmt -76.62 -51.58 11.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.115 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 56' ' ' LEU . 3.9 pp -64.48 -10.5 25.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.911 0.386 . . . . 0.0 110.429 179.22 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.646 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 0.0 OUTLIER -106.66 -8.22 17.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.747 179.501 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.603 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 3.3 m -122.82 79.93 49.39 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.203 -179.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -56.11 -32.75 87.94 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.161 1.907 . . . . 0.0 111.671 178.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -78.53 -51.54 9.81 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.891 -179.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.603 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 20.0 m -69.18 -52.07 31.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.951 0.405 . . . . 0.0 111.554 -177.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.869 ' HG ' HD22 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -57.81 -59.44 5.22 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.373 -178.535 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.672 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.7 OUTLIER -50.02 -33.18 17.26 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.116 -177.949 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.597 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 6.5 t -68.23 -39.1 82.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.2 0.524 . . . . 0.0 110.255 178.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.534 ' HE2' ' SD ' ' A' ' 58' ' ' MET . 1.6 ttpt -65.91 -59.12 4.16 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.434 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.497 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 42.1 t -62.57 -19.28 22.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.516 178.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.656 ' O ' HG22 ' A' ' 73' ' ' VAL . 18.5 t70 -54.88 -48.81 72.52 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 176.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.477 ' HB3' HD13 ' B' ' 6' ' ' LEU . 20.4 tt0 -68.88 -26.85 65.33 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.503 -0.772 . . . . 0.0 109.844 176.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.649 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -63.68 -47.09 82.61 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.185 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.656 HG22 ' O ' ' A' ' 70' ' ' ASP . 3.4 m -60.08 -28.87 42.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 177.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.455 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -70.39 -40.13 74.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.066 178.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.601 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -55.61 -35.45 38.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 CA-C-O 121.102 0.477 . . . . 0.0 109.811 178.862 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.436 HD13 ' C ' ' A' ' 76' ' ' LEU . 2.9 tm? -69.28 -47.28 65.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.754 177.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 20.1 mm-40 -52.07 -36.54 50.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.21 178.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.29 -27.46 35.06 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.63 178.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 79.1 t60 . . . . . 0 C--N 1.332 -0.191 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.496 179.347 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 5' ' ' ASN . . . . . 0.443 ' ND2' HG12 ' A' ' 75' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.768 0.318 . . . . 0.0 110.98 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.515 HD11 ' HG3' ' A' ' 68' ' ' LYS . 5.3 tp -68.66 -74.78 0.12 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.865 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' ASN . . . . . 0.528 ' HB2' HD12 ' A' ' 47' ' ' LEU . 2.0 t30 -92.68 134.62 27.47 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.7 179.244 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -80.18 -4.17 13.04 Favored 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 122.297 1.998 . . . . 0.0 112.389 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 9' ' ' ASN . . . . . 0.506 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 18.0 m120 -123.28 50.9 1.51 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.852 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . 0.437 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.96 96.06 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.219 -0.446 . . . . 0.0 112.068 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.0 OUTLIER -119.07 164.71 15.11 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.685 0.279 . . . . 0.0 110.477 177.445 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . 0.73 ' HA ' ' NZ ' ' A' ' 42' ' ' LYS . 0.7 OUTLIER -62.67 161.86 11.6 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.284 -179.352 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' PHE . . . . . 0.714 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.1 t80 . . . . . 0 C--N 1.332 -0.193 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.71 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.574 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.83 0.348 . . . . 0.0 110.622 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.777 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.757 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 15.3 t . . . . . 0 CA--C 1.521 -0.154 0 CA-C-O 120.641 0.257 . . . . 0.0 110.626 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.82 -33.49 70.46 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.228 0.537 . . . . 0.0 109.628 177.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 14.3 t -74.1 -35.93 64.22 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.874 177.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.757 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.6 mtm -64.37 -36.48 84.26 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.038 177.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.692 HD13 HH12 ' A' ' 27' ' ' ARG . 50.5 mt -53.02 -53.83 44.25 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.93 178.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.29 -25.14 66.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.667 177.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.9 t -101.56 24.65 9.43 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.706 -178.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.939 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 CA--C 1.533 0.302 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.915 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.939 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 1.6 tp10 . . . . . 0 N--CA 1.456 -0.154 0 CA-C-O 120.584 0.231 . . . . 0.0 110.985 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.694 HE22 ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -47.33 -55.08 9.48 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.482 -178.725 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.694 ' HG3' HE22 ' A' ' 20' ' ' GLN . 0.0 OUTLIER -55.79 -26.4 45.89 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.779 -178.444 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.715 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 0.6 OUTLIER -72.47 -76.75 0.11 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.765 0.317 . . . . 0.0 111.643 -179.44 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . 0.556 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.16 -96.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -176.841 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.556 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -62.07 -1.95 0.81 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 113.596 0.962 . . . . 0.0 113.596 -175.219 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.43 ' HA3' HD11 ' A' ' 48' ' ' LEU . . . 65.05 -115.75 8.12 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 108.497 -1.841 . . . . 0.0 108.497 -174.062 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.454 ' O ' HD13 ' A' ' 24' ' ' LEU . 0.5 OUTLIER -75.98 -69.9 0.47 Allowed 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 168.995 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.757 ' HG3' HD21 ' A' ' 31' ' ' LEU . 9.5 tpt180 -159.7 13.22 0.14 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 114.282 -1.326 . . . . 0.0 108.029 175.256 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.634 HD12 HD11 ' A' ' 32' ' ' ILE . 3.9 mm? -57.32 -76.46 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.513 -1.221 . . . . 0.0 113.506 -174.218 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.639 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -37.25 -49.87 2.36 Favored Pre-proline 0 CA--C 1.535 0.381 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -175.122 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.556 ' HG2' ' HD2' ' A' ' 27' ' ' ARG . 50.0 Cg_exo -56.71 -43.64 52.86 Favored 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 122.249 1.966 . . . . 0.0 113.64 -177.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.781 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.66 -47.39 60.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.141 0.496 . . . . 0.0 110.185 -178.432 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.753 HG21 HD12 ' A' ' 43' ' ' ILE . 0.5 OUTLIER -75.36 -13.16 15.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.499 178.845 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.658 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 8.7 tp-100 -62.59 -39.55 94.07 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 177.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.55 -31.93 72.95 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.266 -0.879 . . . . 0.0 108.814 174.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . 0.492 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 6.2 mtt -100.73 27.2 6.08 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.409 177.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.658 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.9 p-80 -64.06 -33.19 8.92 Favored Pre-proline 0 CA--C 1.535 0.399 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 -177.097 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.546 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 53.2 Cg_exo -37.11 -30.39 0.11 Allowed 'Trans proline' 0 C--N 1.361 1.187 0 C-N-CA 122.286 1.991 . . . . 0.0 112.36 179.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.912 HG21 HG13 ' A' ' 73' ' ' VAL . 90.2 m -78.28 -85.17 0.07 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.238 177.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.533 ' O ' HG13 ' A' ' 43' ' ' ILE . 7.9 tp -171.11 51.29 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.21 178.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.456 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -39.83 -38.18 0.64 Allowed 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.852 -179.547 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.639 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.08 -55.72 9.87 Favored Glycine 0 C--N 1.331 0.289 0 CA-C-N 116.096 -0.502 . . . . 0.0 114.012 -179.174 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.899 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -78.27 -34.27 49.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 117.098 0.449 . . . . 0.0 111.817 -178.654 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.753 HD12 HG21 ' A' ' 32' ' ' ILE . 0.9 OUTLIER -54.11 -55.84 12.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.613 0.245 . . . . 0.0 111.238 -179.083 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.559 HG21 ' CD2' ' A' ' 29' ' ' PHE . 5.2 t -47.22 -49.17 23.67 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.477 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.575 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -50.23 -51.44 30.98 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 121.092 -0.575 . . . . 0.0 112.901 179.149 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.516 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 3.1 mmm -55.72 -68.05 0.23 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.332 0.587 . . . . 0.0 111.364 -179.404 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.74 HD11 ' HB2' ' B' ' 6' ' ' LEU . 4.0 mm? -74.15 10.62 1.16 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.184 -0.917 . . . . 0.0 111.701 -177.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.522 ' HB3' ' HD2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -66.17 -24.39 66.64 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.972 0.415 . . . . 0.0 110.302 178.835 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.479 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 3.0 mt-10 -74.59 22.38 0.1 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.967 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.628 HD11 ' HE3' ' A' ' 68' ' ' LYS . 2.6 tt -83.63 166.87 2.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.76 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.447 ' HB2' ' HG3' ' A' ' 54' ' ' GLU . 7.6 m-20 -70.82 155.29 40.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.419 -179.422 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.882 ' HA ' HD23 ' A' ' 55' ' ' LEU . 4.8 m120 -83.21 -29.62 28.38 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.064 178.062 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.06 -31.88 63.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.747 177.547 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.447 ' HG3' ' HB2' ' A' ' 51' ' ' ASP . 6.1 mt-10 -79.46 -27.17 41.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.699 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.882 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -59.47 -46.73 87.97 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.084 0.469 . . . . 0.0 109.925 179.123 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.496 ' O ' ' HG3' ' A' ' 60' ' ' GLU . 1.0 OUTLIER -61.2 -44.93 96.49 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.653 179.403 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 25.7 t60 -57.08 -40.33 76.7 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.055 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.527 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -58.91 -42.39 89.51 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.645 179.184 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.653 HD12 ' NE ' ' A' ' 27' ' ' ARG . 9.0 tt -63.8 -24.53 67.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.063 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.496 ' HG3' ' O ' ' A' ' 56' ' ' LEU . 17.4 mt-10 -105.3 2.89 29.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.338 -178.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.565 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 43.6 m -122.66 78.24 47.66 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.675 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.458 ' O ' ' HB2' ' A' ' 66' ' ' ARG . 18.7 Cg_endo -57.84 -34.94 98.94 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.339 2.026 . . . . 0.0 112.099 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -78.39 -46.96 18.63 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.728 -179.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.524 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 12.8 m -72.91 -53.39 11.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.648 -177.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.781 HD21 HD13 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -57.82 -58.9 6.34 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.264 -178.387 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.686 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -50.94 -36.24 37.61 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.859 -0.337 . . . . 0.0 111.102 -178.246 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.4 m -69.39 -36.25 76.58 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.071 0.462 . . . . 0.0 110.292 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.628 ' HE3' HD11 ' A' ' 50' ' ' ILE . 5.5 ttpt -65.77 -56.26 12.89 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.263 178.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.52 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 30.2 t -64.85 -21.23 28.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.36 178.537 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.428 ' HB2' ' O ' ' A' ' 66' ' ' ARG . 13.7 t70 -53.45 -48.03 69.18 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 177.295 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.419 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 0.4 OUTLIER -68.83 -32.92 72.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.767 176.836 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.646 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -55.69 -42.44 75.2 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.163 177.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.912 HG13 HG21 ' A' ' 38' ' ' THR . 24.4 t -60.82 -31.65 50.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 176.647 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.419 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -73.46 -36.41 65.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.604 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.569 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -57.73 -28.22 31.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.895 0.379 . . . . 0.0 110.092 179.79 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.899 HD11 ' HB3' ' A' ' 42' ' ' LYS . 3.0 mm? -71.62 -54.31 10.83 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.534 178.358 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -51.12 -34.63 31.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.439 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.5 -30.91 33.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.828 178.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 12.5 t-160 . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.083 -179.762 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.641 0.258 . . . . 0.0 111.078 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.74 ' HB2' HD11 ' A' ' 47' ' ' LEU . 16.6 mt -64.85 -87.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.774 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' ASN . . . . . 0.685 HD22 ' H ' ' B' ' 9' ' ' ASN . 0.5 OUTLIER -74.46 124.97 90.19 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.708 179.212 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -79.07 3.82 7.08 Favored 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.18 1.92 . . . . 0.0 112.111 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 9' ' ' ASN . . . . . 0.685 ' H ' HD22 ' B' ' 7' ' ' ASN . 32.8 m-80 -123.53 44.5 2.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.902 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . 0.516 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.57 98.13 0.06 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.494 179.552 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.507 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.1 OUTLIER -122.24 -179.51 4.2 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.634 178.848 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -68.46 172.29 6.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.82 179.055 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' PHE . . . . . 0.575 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.1 t80 . . . . . 0 C--N 1.331 -0.204 0 CA-C-O 120.974 0.416 . . . . 0.0 110.93 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.67 ' HG2' HE22 ' A' ' 20' ' ' GLN . 9.1 mttt . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.907 0.384 . . . . 0.0 110.788 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.522 ' HD2' ' HB3' ' A' ' 48' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.902 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.792 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 3.6 t . . . . . 0 N--CA 1.456 -0.171 0 CA-C-O 120.695 0.283 . . . . 0.0 110.273 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.37 -35.43 73.9 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 176.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.7 t -71.08 -36.19 72.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.623 177.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.792 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.3 mtm -64.23 -34.4 78.01 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.896 177.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.686 HD12 ' SD ' ' A' ' 23' ' ' MET . 1.2 mp -52.74 -52.61 55.68 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.843 178.351 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.02 -26.99 67.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.915 178.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.7 p -101.5 21.23 14.61 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.74 -178.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.902 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 CA--C 1.534 0.358 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.208 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.902 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 1.7 tp10 . . . . . 0 N--CA 1.456 -0.148 0 CA-C-O 120.88 0.371 . . . . 0.0 110.373 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.496 HE22 ' HG2' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -51.53 -68.29 0.18 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.628 -179.082 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.561 ' HE2' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.4 -18.49 6.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.371 -178.066 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.648 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 5.4 tp60 -73.6 -79.82 0.08 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.901 0.381 . . . . 0.0 111.336 178.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . 0.686 ' SD ' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.57 -96.09 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 N-CA-C 112.616 0.599 . . . . 0.0 112.616 -177.08 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.628 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -61.04 0.43 0.23 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.059 0.762 . . . . 0.0 113.059 -176.064 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.584 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.4 -118.12 12.1 Favored Glycine 0 N--CA 1.446 -0.655 0 N-CA-C 108.332 -1.907 . . . . 0.0 108.332 -175.011 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.444 ' O ' HD13 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -75.98 -67.65 0.66 Allowed 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 168.71 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.631 ' HB2' HD13 ' A' ' 55' ' ' LEU . 5.2 tpt180 -160.16 12.0 0.12 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.385 -1.28 . . . . 0.0 108.442 175.373 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.621 HD12 HD11 ' A' ' 32' ' ' ILE . 4.2 mm? -57.82 -80.44 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.846 -1.07 . . . . 0.0 113.713 -174.16 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.675 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -33.46 -50.16 0.74 Allowed Pre-proline 0 CA--C 1.537 0.446 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -175.223 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.603 ' HG2' ' O ' ' A' ' 27' ' ' ARG . 12.7 Cg_endo -59.16 -42.15 53.4 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.204 1.936 . . . . 0.0 113.521 -177.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.624 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.09 -45.76 63.08 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 120.144 -0.622 . . . . 0.0 110.151 -179.147 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.621 HD11 HD12 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -74.7 -12.36 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.998 178.142 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.642 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 60.3 tp60 -62.13 -39.29 92.08 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 176.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.0 -31.66 71.52 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.298 -0.864 . . . . 0.0 109.076 174.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . 0.521 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 7.1 mtt -100.54 28.13 5.31 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.225 178.014 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.642 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.2 OUTLIER -64.09 -31.95 6.88 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 -177.267 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.543 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 63.0 Cg_exo -37.68 -30.51 0.14 Allowed 'Trans proline' 0 C--N 1.361 1.236 0 C-N-CA 122.047 1.831 . . . . 0.0 112.159 179.055 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.906 HG21 HG13 ' A' ' 73' ' ' VAL . 0.2 OUTLIER -78.16 -89.11 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.737 176.578 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.53 ' H ' ' HB ' ' A' ' 38' ' ' THR . 0.1 OUTLIER -171.24 58.4 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.92 177.718 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.49 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -43.47 -35.4 1.61 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.743 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.661 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.16 -57.42 8.02 Favored Glycine 0 C--O 1.229 -0.216 0 CA-C-N 115.961 -0.563 . . . . 0.0 114.098 -178.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.537 ' HE3' ' HA ' ' B' ' 12' ' ' GLU . 1.6 tptm -79.03 -39.01 35.11 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 117.085 0.442 . . . . 0.0 112.15 -178.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.697 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 17.2 mt -53.09 -48.62 53.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 C-N-CA 121.155 -0.218 . . . . 0.0 111.426 -177.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.527 HG21 ' CD2' ' A' ' 29' ' ' PHE . 5.1 t -47.86 -48.04 31.33 Favored 'General case' 0 CA--C 1.521 -0.17 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 178.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.565 ' CA ' ' HB2' ' B' ' 13' ' ' PHE . . . -56.67 -53.25 45.17 Favored Glycine 0 N--CA 1.449 -0.458 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.871 179.212 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.921 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.33 -56.43 20.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.794 0.33 . . . . 0.0 110.982 -179.112 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.623 HD22 ' HB2' ' A' ' 46' ' ' MET . 2.9 mm? -80.28 7.76 8.83 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.397 -179.247 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.484 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.46 -20.9 66.55 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.791 0.329 . . . . 0.0 110.748 179.897 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.48 ' HG3' ' O ' ' B' ' 9' ' ' ASN . 3.6 mt-10 -75.71 20.27 0.18 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.888 179.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.64 HD11 ' HE3' ' A' ' 68' ' ' LYS . 2.7 tt -83.58 169.07 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.905 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.44 ' HB2' ' HG3' ' A' ' 54' ' ' GLU . 2.6 m-20 -71.03 155.93 40.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.951 0.405 . . . . 0.0 111.427 -179.626 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.809 ' HA ' HD23 ' A' ' 55' ' ' LEU . 4.2 m120 -88.06 -28.46 21.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.643 177.238 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.96 -30.67 62.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.608 177.125 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.578 ' O ' ' HG2' ' A' ' 58' ' ' MET . 4.0 mt-10 -77.26 -29.41 53.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.49 178.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.809 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -58.79 -46.1 88.36 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.209 -179.901 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.428 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 7.6 tp -60.75 -47.38 86.56 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.558 178.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -65.72 -20.07 66.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.375 -179.644 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.631 ' SD ' ' HA ' ' A' ' 65' ' ' LEU . 25.3 mmt -69.65 -54.57 13.28 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.054 -179.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.54 HD23 ' CG ' ' A' ' 27' ' ' ARG . 0.1 OUTLIER -63.27 -17.87 62.96 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.893 0.377 . . . . 0.0 110.685 179.479 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.478 ' O ' ' HG3' ' A' ' 60' ' ' GLU . 0.0 OUTLIER -94.73 -13.26 25.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.788 -179.856 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.595 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.5 OUTLIER -122.3 87.66 48.44 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.189 -179.872 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -59.31 -32.22 96.41 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.268 1.979 . . . . 0.0 112.129 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -77.78 -49.77 13.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.618 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.421 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 75.5 m -69.16 -46.34 67.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.185 -178.469 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.631 ' HA ' ' SD ' ' A' ' 58' ' ' MET . 1.2 tp -60.17 -64.74 0.84 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.814 -178.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.57 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -49.54 -28.83 5.98 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.875 -177.933 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.482 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 9.2 t -62.32 -45.32 93.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.181 177.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.64 ' HE3' HD11 ' A' ' 50' ' ' ILE . 14.2 mtmm -66.45 -62.05 1.67 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.921 179.355 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.471 ' HA ' ' HB3' ' A' ' 72' ' ' ALA . 73.2 t -57.75 -20.72 14.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.756 -179.321 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.482 ' HB3' ' O ' ' A' ' 67' ' ' SER . 10.0 t70 -57.26 -49.22 76.74 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 175.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.468 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 5.7 tt0 -67.18 -27.76 67.54 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.547 175.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.697 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -66.1 -36.68 83.83 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.586 178.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.906 HG13 HG21 ' A' ' 38' ' ' THR . 5.1 t -59.94 -32.85 50.94 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.184 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 176.23 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -73.69 -34.18 64.76 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.824 175.379 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.594 ' HB ' ' O ' ' A' ' 72' ' ' ALA . 15.7 t -55.03 -33.07 28.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.919 178.205 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.634 ' HB2' HG12 ' A' ' 43' ' ' ILE . 3.1 tm? -71.36 -47.08 58.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.173 177.581 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 32.6 mm-40 -63.87 -24.05 67.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.048 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.8 -24.94 38.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.834 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 26.1 t-80 . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.861 179.785 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 9.1 m120 . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.65 0.262 . . . . 0.0 110.943 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.582 ' HB3' HD11 ' A' ' 47' ' ' LEU . 27.1 tp -71.92 -83.68 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.381 179.318 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' ASN . . . . . 0.495 HD22 ' H ' ' B' ' 9' ' ' ASN . 1.9 t30 -82.81 129.15 63.08 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.267 178.151 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 7.1 Cg_exo -73.94 4.25 4.35 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.187 1.924 . . . . 0.0 111.997 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 9' ' ' ASN . . . . . 0.495 ' H ' HD22 ' B' ' 7' ' ' ASN . 18.5 m120 -123.63 37.42 4.42 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.308 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . 0.921 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.43 87.5 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.087 179.263 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.45 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 1.5 mmtp -116.21 177.86 4.53 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.964 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . 0.537 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -68.21 158.76 32.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.72 0.295 . . . . 0.0 111.065 179.76 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' PHE . . . . . 0.565 ' HB2' ' CA ' ' A' ' 45' ' ' GLY . 1.1 t80 . . . . . 0 C--N 1.332 -0.166 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.857 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.496 ' HG2' HE22 ' A' ' 20' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.782 0.325 . . . . 0.0 110.672 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.331 -0.237 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.943 -179.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.815 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 12.7 t . . . . . 0 N--CA 1.455 -0.225 0 CA-C-O 120.742 0.306 . . . . 0.0 110.236 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.61 -41.01 89.41 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 176.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 7.5 t -67.44 -33.79 75.88 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.508 176.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.815 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.1 mtm -64.25 -37.24 86.79 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.182 177.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.842 HD21 ' HB3' ' A' ' 24' ' ' LEU . 22.9 mt -54.28 -45.99 72.62 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.547 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.8 -36.3 82.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.102 178.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -101.16 46.55 0.94 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.047 -179.655 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.794 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 CA--C 1.536 0.437 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 -178.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.794 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 1.1 tp10 . . . . . 0 N--CA 1.46 0.03 0 CA-C-O 120.64 0.257 . . . . 0.0 110.876 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.673 HE22 ' HG2' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -47.0 -56.7 5.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.605 -178.853 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.621 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -56.07 -22.34 27.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.648 -178.359 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.621 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 5.4 tp60 -73.46 -79.91 0.08 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.915 0.388 . . . . 0.0 111.677 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . 0.742 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.76 -96.22 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -176.47 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.842 ' HB3' HD21 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -59.26 -2.45 0.29 Allowed 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 113.647 0.98 . . . . 0.0 113.647 -175.359 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.636 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.48 -116.78 9.45 Favored Glycine 0 N--CA 1.448 -0.549 0 N-CA-C 108.374 -1.891 . . . . 0.0 108.374 -174.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.446 ' HG2' ' O ' ' A' ' 51' ' ' ASP . 0.8 OUTLIER -76.23 -69.14 0.52 Allowed 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 168.269 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.766 ' NE ' HD13 ' A' ' 59' ' ' LEU . 0.2 OUTLIER -159.82 13.1 0.13 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.163 -1.381 . . . . 0.0 108.178 174.56 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.546 ' O ' HG13 ' A' ' 32' ' ' ILE . 4.1 mm? -57.64 -78.57 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.662 -1.153 . . . . 0.0 113.439 -174.379 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.617 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -37.42 -48.88 2.47 Favored Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 -174.799 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.59 ' HG3' ' HB2' ' A' ' 24' ' ' LEU . 12.6 Cg_endo -58.69 -43.29 45.82 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 122.14 1.893 . . . . 0.0 113.621 -177.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.19 -46.69 60.74 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 120.111 -0.636 . . . . 0.0 110.289 -178.719 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.546 HG13 ' O ' ' A' ' 28' ' ' LEU . 0.4 OUTLIER -73.28 -12.47 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 CA-C-N 116.208 -0.451 . . . . 0.0 109.969 178.224 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.608 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 47.7 tp60 -62.14 -40.54 96.3 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 176.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.62 -29.98 69.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.08 174.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . 0.536 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 6.7 mtt -101.65 27.17 6.61 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.394 178.428 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.608 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -63.66 -32.08 7.49 Favored Pre-proline 0 CA--C 1.537 0.445 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -177.594 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.572 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 50.5 Cg_exo -35.97 -32.55 0.1 Allowed 'Trans proline' 0 C--N 1.363 1.342 0 C-N-CA 122.178 1.919 . . . . 0.0 112.034 178.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.837 HG21 HG13 ' A' ' 73' ' ' VAL . 7.2 m -78.14 -88.58 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.512 176.014 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.509 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.3 OUTLIER -171.59 62.73 0.03 OUTLIER 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.196 177.552 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.516 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -46.67 -34.72 5.32 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.662 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.617 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -52.88 -53.94 30.93 Favored Glycine 0 C--N 1.33 0.239 0 C-N-CA 121.17 -0.538 . . . . 0.0 113.81 -178.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.501 ' HD2' ' HG2' ' B' ' 12' ' ' GLU . 0.0 OUTLIER -78.11 -39.0 42.7 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.887 0.343 . . . . 0.0 111.797 -178.387 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.692 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 31.8 mt -53.95 -54.14 22.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.038 -179.385 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.583 HG21 ' CD2' ' A' ' 29' ' ' PHE . 6.4 t -50.17 -45.69 53.58 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 120.889 0.376 . . . . 0.0 110.121 178.003 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.565 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -50.83 -67.46 1.92 Allowed Glycine 0 N--CA 1.451 -0.317 0 CA-C-N 115.606 -0.724 . . . . 0.0 113.235 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.462 ' H ' ' HG2' ' A' ' 46' ' ' MET . 0.0 OUTLIER -56.05 -46.06 79.05 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 -178.031 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.44 HD22 ' N ' ' A' ' 47' ' ' LEU . 3.3 mm? -80.11 3.09 21.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.719 -0.219 . . . . 0.0 111.588 -178.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.565 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.96 -8.24 21.51 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.938 0.399 . . . . 0.0 110.54 179.253 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.449 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 1.4 mm-40 -83.47 18.36 1.87 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.373 178.433 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.405 HG23 ' O ' ' A' ' 51' ' ' ASP . 1.5 tt -83.27 163.85 2.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.96 -179.272 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.446 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 3.4 m-20 -70.81 157.56 37.88 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.564 -179.124 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.83 ' HA ' HD23 ' A' ' 55' ' ' LEU . 4.6 m120 -86.61 -28.83 23.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.969 177.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 8.7 m -73.9 -32.09 63.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.644 177.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -75.98 -29.5 58.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.554 178.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.83 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.5 OUTLIER -59.45 -47.74 84.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.504 -179.766 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.462 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 52.4 tp -61.7 -40.72 96.02 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.712 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -66.02 -30.95 71.58 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.164 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.48 -54.85 22.38 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.897 -179.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.766 HD13 ' NE ' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -66.1 -13.08 59.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.115 0.483 . . . . 0.0 110.123 178.76 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.506 ' HG3' ' O ' ' A' ' 60' ' ' GLU . 2.3 tp10 -95.46 -12.92 25.07 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.631 177.537 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.547 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 4.1 m -122.57 79.58 47.21 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.732 179.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -54.58 -34.21 81.87 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.398 2.065 . . . . 0.0 112.206 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -77.95 -49.72 13.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.552 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.445 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 3.7 m -71.23 -23.12 61.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.904 0.383 . . . . 0.0 111.4 -178.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.549 ' HG ' ' N ' ' A' ' 66' ' ' ARG . 1.7 tp -78.54 -64.87 1.07 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.639 -178.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.549 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 1.5 ttm180 -51.43 -29.27 15.41 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.849 -178.104 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.56 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 3.3 t -69.67 -40.84 76.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.301 0.572 . . . . 0.0 110.005 177.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.628 ' O ' HD11 ' B' ' 6' ' ' LEU . 21.4 ttpt -65.74 -59.69 3.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.203 178.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.506 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 54.1 t -62.47 -19.89 23.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.637 179.222 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.56 ' HB3' ' O ' ' A' ' 67' ' ' SER . 17.1 t70 -54.07 -48.99 70.05 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 176.531 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -66.77 -32.9 74.5 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.658 176.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.692 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -58.19 -38.11 76.09 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.525 178.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.837 HG13 HG21 ' A' ' 38' ' ' THR . 8.0 t -65.26 -31.4 53.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.61 177.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.1 -37.08 69.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.146 179.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.66 HG12 ' HB2' ' B' ' 5' ' ' ASN . 0.9 OUTLIER -57.61 -31.71 40.2 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.115 0 CA-C-O 121.168 0.508 . . . . 0.0 109.955 178.989 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.64 HD12 HG22 ' A' ' 38' ' ' THR . 2.8 tm? -71.24 -49.91 38.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.39 179.061 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -54.94 -37.33 66.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.664 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.15 -24.28 37.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.811 179.133 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 0.419 ' HB2' ' O ' ' A' ' 75' ' ' VAL . 6.6 t60 . . . . . 0 C--N 1.33 -0.243 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.816 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 5' ' ' ASN . . . . . 0.66 ' HB2' HG12 ' A' ' 75' ' ' VAL . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.735 0.303 . . . . 0.0 110.881 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.628 HD11 ' O ' ' A' ' 68' ' ' LYS . 5.6 mt -62.81 -85.32 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.808 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 7' ' ' ASN . . . . . 0.448 ' HA ' ' HD3' ' B' ' 8' ' ' PRO . 2.7 t30 -75.85 130.05 79.63 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.866 179.538 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 6.6 Cg_exo -73.28 -3.41 13.63 Favored 'Trans proline' 0 N--CA 1.46 -0.475 0 C-N-CA 122.368 2.045 . . . . 0.0 111.625 178.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 9' ' ' ASN . . . . . 0.409 ' HB3' ' NZ ' ' B' ' 11' ' ' LYS . 7.9 m120 -123.48 51.97 1.45 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.636 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.86 95.67 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.756 -179.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.449 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 9.6 mttp -121.57 121.69 37.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.027 178.072 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . 0.501 ' HG2' ' HD2' ' A' ' 42' ' ' LYS . 6.0 mt-10 -49.68 176.87 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.315 0.579 . . . . 0.0 112.366 -177.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' PHE . . . . . 0.552 ' CE1' ' HG ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.519 -0.213 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.248 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.673 ' HG2' HE22 ' A' ' 20' ' ' GLN . 9.0 mttt . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.925 0.393 . . . . 0.0 110.625 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.444 ' HB3' ' O ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.0 -179.222 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.721 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 3.0 t . . . . . 0 CA--C 1.521 -0.136 0 CA-C-O 120.513 0.197 . . . . 0.0 110.717 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.453 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.18 -36.1 74.74 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 177.406 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.8 t -70.21 -34.81 73.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.729 177.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.721 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 4.1 mtm -64.36 -35.34 80.56 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.823 177.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.753 HD11 ' HB3' ' A' ' 24' ' ' LEU . 3.8 mp -52.47 -51.21 60.49 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.994 178.769 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.96 -26.92 67.79 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.778 178.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.7 15.85 27.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.688 -178.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.883 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 CA--C 1.534 0.335 0 CA-C-O 120.546 0.212 . . . . 0.0 111.272 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.883 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 1.3 tp10 . . . . . 0 N--CA 1.454 -0.27 0 CA-C-O 120.737 0.303 . . . . 0.0 110.782 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.604 HE22 ' HG2' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -47.72 -62.17 1.58 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.424 -178.423 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.642 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.73 -20.92 16.3 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.895 -177.049 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.642 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 23.5 tt0 -73.81 -80.3 0.08 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.013 0.435 . . . . 0.0 111.683 179.309 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . 0.736 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -70.16 -96.84 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.04 0.755 . . . . 0.0 113.04 -176.453 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.753 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -57.69 0.83 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -175.422 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.587 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.86 -118.06 11.63 Favored Glycine 0 N--CA 1.446 -0.681 0 N-CA-C 108.349 -1.901 . . . . 0.0 108.349 -174.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.508 ' HG3' ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -76.07 -67.31 0.69 Allowed 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 168.713 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.73 ' HD3' HD12 ' A' ' 24' ' ' LEU . 0.3 OUTLIER -160.09 8.12 0.1 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.262 -1.335 . . . . 0.0 108.142 175.278 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 1.028 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.3 OUTLIER -59.28 -78.21 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.305 -1.316 . . . . 0.0 113.942 -173.656 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.637 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -33.67 -48.88 0.75 Allowed Pre-proline 0 CA--C 1.535 0.397 0 N-CA-C 113.758 1.022 . . . . 0.0 113.758 -175.147 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.613 ' HG3' ' HB2' ' A' ' 24' ' ' LEU . 18.9 Cg_endo -61.01 -42.86 33.63 Favored 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 122.137 1.891 . . . . 0.0 113.291 -178.052 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.72 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.36 -44.9 64.13 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 119.956 -0.698 . . . . 0.0 110.153 -179.566 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.725 HD11 HD23 ' A' ' 28' ' ' LEU . 0.5 OUTLIER -73.05 -14.46 16.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 CA-C-N 116.233 -0.44 . . . . 0.0 109.891 178.018 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.642 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 4.4 tp-100 -62.41 -38.69 90.64 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 176.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.42 -30.12 69.79 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.327 -0.851 . . . . 0.0 108.939 174.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . 0.596 ' HE2' ' HE ' ' A' ' 66' ' ' ARG . 6.8 mtt -102.18 26.28 7.87 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.209 177.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.642 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.9 p-80 -64.59 -32.08 6.57 Favored Pre-proline 0 CA--C 1.536 0.41 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 -177.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.586 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 44.4 Cg_exo -35.1 -34.06 0.1 OUTLIER 'Trans proline' 0 C--N 1.363 1.317 0 C-N-CA 122.24 1.96 . . . . 0.0 112.319 178.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.61 HG22 HD12 ' A' ' 76' ' ' LEU . 52.6 m -78.52 -87.61 0.06 Allowed 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.678 176.358 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.55 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 0.1 OUTLIER -171.47 63.78 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.49 178.102 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.511 ' HA ' HD12 ' A' ' 43' ' ' ILE . . . -47.96 -34.69 9.56 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 120.873 0.368 . . . . 0.0 111.622 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.637 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -51.5 -56.93 13.16 Favored Glycine 0 CA--C 1.518 0.23 0 CA-C-N 115.948 -0.569 . . . . 0.0 114.034 -178.379 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.6 ' HE2' ' SD ' ' A' ' 46' ' ' MET . 2.5 tptm -75.6 -35.65 60.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 117.034 0.417 . . . . 0.0 111.686 -177.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.661 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 41.2 mt -54.02 -59.48 2.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.139 -179.37 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 1.028 ' HA ' HD22 ' A' ' 28' ' ' LEU . 11.0 t -47.82 -43.12 27.71 Favored 'General case' 0 CA--C 1.522 -0.129 0 CA-C-O 120.85 0.357 . . . . 0.0 110.444 178.863 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.696 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -48.23 -71.79 0.53 Allowed Glycine 0 N--CA 1.45 -0.396 0 CA-C-N 115.738 -0.665 . . . . 0.0 113.232 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.628 ' HE3' HG23 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -55.7 -43.41 76.44 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 117.035 0.417 . . . . 0.0 111.723 -178.399 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.519 ' CD1' ' HB2' ' B' ' 7' ' ' ASN . 3.1 mm? -79.84 5.64 13.15 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.682 0.253 . . . . 0.0 111.682 -178.517 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.64 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.17 -12.02 53.23 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.868 0.366 . . . . 0.0 110.605 179.627 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.449 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.1 mm-40 -78.0 17.65 0.57 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.364 177.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.419 ' HB ' ' O ' ' A' ' 47' ' ' LEU . 0.9 OUTLIER -83.45 159.46 3.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.1 -179.398 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.613 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 3.9 m-20 -71.01 151.1 44.96 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -178.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.806 ' HA ' HD23 ' A' ' 55' ' ' LEU . 2.2 t-20 -80.52 -30.51 37.19 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.679 177.016 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 39.6 m -73.99 -31.87 63.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.662 177.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.613 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 0.9 OUTLIER -76.55 -27.87 56.08 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.536 178.746 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.806 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -59.39 -48.73 80.51 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.355 179.841 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.468 ' HA ' HD22 ' A' ' 56' ' ' LEU . 0.9 OUTLIER -60.7 -43.61 97.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.551 179.614 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -59.59 -32.57 70.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.22 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.473 ' HB3' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -65.94 -45.41 81.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.324 -179.408 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.604 HD23 ' CG ' ' A' ' 27' ' ' ARG . 0.2 OUTLIER -67.15 -16.19 64.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.261 -179.524 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -98.79 -11.13 22.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.869 0.366 . . . . 0.0 110.915 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.59 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -123.68 86.48 52.85 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.864 179.859 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -60.35 -33.37 94.41 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.368 2.045 . . . . 0.0 112.216 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.598 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -77.98 -44.99 25.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.193 -179.723 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.598 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 14.5 m -73.83 -25.97 60.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.934 0.397 . . . . 0.0 111.051 -179.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.592 HD11 HD13 ' A' ' 31' ' ' LEU . 1.9 tp -78.76 -65.69 0.96 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.621 -178.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.596 ' HE ' ' HE2' ' A' ' 35' ' ' MET . 0.1 OUTLIER -51.4 -28.09 11.79 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.973 -178.0 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.576 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 28.7 t -69.42 -42.68 74.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.149 0.499 . . . . 0.0 110.094 178.129 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.655 ' HG2' HD21 ' B' ' 6' ' ' LEU . 2.5 ttmm -66.08 -57.22 8.2 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.55 179.278 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.542 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 52.9 t -64.11 -18.73 23.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.636 179.289 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.616 ' O ' HG22 ' A' ' 73' ' ' VAL . 21.9 t70 -55.65 -49.95 71.52 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 176.552 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.507 ' HB3' HD13 ' B' ' 6' ' ' LEU . 25.7 tt0 -68.53 -24.94 64.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.771 177.159 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.712 ' O ' HG22 ' A' ' 75' ' ' VAL . . . -63.26 -50.58 69.62 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.191 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.616 HG22 ' O ' ' A' ' 70' ' ' ASP . 3.7 m -58.15 -29.19 36.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 178.178 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.413 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -70.09 -36.75 75.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.083 179.004 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.712 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.3 m -59.67 -31.92 48.16 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.123 0 CA-C-O 121.078 0.466 . . . . 0.0 110.016 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.61 HD12 HG22 ' A' ' 38' ' ' THR . 2.4 tm? -71.91 -49.85 34.29 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.317 178.228 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.485 HE21 HG23 ' A' ' 38' ' ' THR . 48.0 mm-40 -54.44 -39.82 67.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.51 179.479 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.48 -19.62 41.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.095 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 0.434 ' HB2' ' O ' ' A' ' 75' ' ' VAL . 4.0 t60 . . . . . 0 C--N 1.331 -0.209 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.016 -179.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 5' ' ' ASN . . . . . 0.503 ' HB2' HG12 ' A' ' 75' ' ' VAL . 7.3 m120 . . . . . 0 C--O 1.233 0.2 0 CA-C-O 120.738 0.304 . . . . 0.0 111.291 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.655 HD21 ' HG2' ' A' ' 68' ' ' LYS . 6.0 tp -62.43 -82.44 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.612 -179.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 7' ' ' ASN . . . . . 0.565 HD22 ' H ' ' B' ' 9' ' ' ASN . 2.3 t30 -75.22 136.46 72.42 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.651 178.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.72 -10.72 18.49 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 122.117 1.878 . . . . 0.0 111.819 178.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 9' ' ' ASN . . . . . 0.565 ' H ' HD22 ' B' ' 7' ' ' ASN . 4.0 m120 -123.93 63.25 1.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.769 179.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . 0.474 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.15 92.06 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.561 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.541 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.2 OUTLIER -118.66 123.64 45.43 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.284 178.592 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . 0.514 ' HG2' ' HE3' ' A' ' 42' ' ' LYS . 8.5 mt-10 -47.97 172.14 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.251 0.548 . . . . 0.0 112.366 -178.149 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' PHE . . . . . 0.696 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.5 OUTLIER . . . . . 0 C--N 1.332 -0.156 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.799 179.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.604 ' HG2' HE22 ' A' ' 20' ' ' GLN . 4.3 mtmp? . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.879 0.371 . . . . 0.0 110.985 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 1.2 t80 . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.049 -179.648 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.729 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 4.8 t . . . . . 0 N--CA 1.456 -0.173 0 CA-C-O 120.541 0.21 . . . . 0.0 110.552 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.451 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.45 -39.02 82.26 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 177.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.14 -34.83 73.54 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.651 177.221 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.729 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 3.2 mtm -64.46 -34.78 78.99 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.765 177.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.646 HD21 ' NH1' ' A' ' 27' ' ' ARG . 1.9 mp -52.58 -52.18 56.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.111 178.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.88 -26.25 67.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.781 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -101.83 15.78 27.93 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.699 -179.005 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.98 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 CA--C 1.532 0.276 0 CA-C-N 116.71 -0.223 . . . . 0.0 111.446 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.98 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 2.1 tp10 . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 120.822 0.344 . . . . 0.0 110.817 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.632 HE22 ' HG2' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -53.47 -62.79 1.42 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.356 -179.468 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.462 ' H ' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -55.63 -20.68 14.67 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.361 -178.079 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.691 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 0.8 OUTLIER -73.94 -78.63 0.09 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.04 0.448 . . . . 0.0 111.37 178.636 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . 0.613 ' SD ' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.24 -96.35 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -176.665 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.589 ' HB2' ' CG ' ' A' ' 30' ' ' PRO . 0.4 OUTLIER -61.4 1.52 0.2 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -175.038 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.532 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 65.08 -117.18 9.86 Favored Glycine 0 N--CA 1.444 -0.794 0 N-CA-C 108.344 -1.903 . . . . 0.0 108.344 -174.3 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.425 ' O ' HD13 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -75.9 -66.81 0.74 Allowed 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 169.345 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.905 ' HG3' HD21 ' A' ' 31' ' ' LEU . 22.1 tpt180 -160.36 5.51 0.08 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.273 -1.33 . . . . 0.0 107.89 176.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.971 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.28 -74.6 0.07 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.169 -1.378 . . . . 0.0 114.394 -172.554 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.715 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.2 OUTLIER -33.17 -49.1 0.64 Allowed Pre-proline 0 CA--C 1.542 0.639 0 N-CA-C 113.256 0.835 . . . . 0.0 113.256 -175.204 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.589 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 38.0 Cg_exo -61.82 -40.15 46.94 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 122.513 2.142 . . . . 0.0 113.669 -178.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.976 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.13 -47.76 60.36 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 -179.347 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.646 HD11 HD23 ' A' ' 28' ' ' LEU . 0.5 OUTLIER -73.1 -13.2 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.637 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.878 177.478 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.654 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 45.7 tt0 -62.41 -41.04 98.38 Favored 'General case' 0 CA--C 1.518 -0.256 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 177.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.85 -29.97 70.02 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 175.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . 0.533 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 4.7 mtt -101.75 26.19 7.72 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.23 178.191 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.654 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 3.2 p-80 -62.38 -32.76 10.07 Favored Pre-proline 0 CA--C 1.537 0.479 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -176.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.558 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 55.0 Cg_exo -36.43 -30.78 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.282 0 C-N-CA 122.151 1.901 . . . . 0.0 112.211 179.171 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.799 HG21 HG13 ' A' ' 73' ' ' VAL . 3.5 m -78.21 -89.13 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.73 176.474 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.518 HD12 ' H ' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -171.51 59.44 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.168 177.975 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.467 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -43.57 -39.47 3.49 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.6 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.6 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.83 -56.49 9.83 Favored Glycine 0 C--N 1.329 0.186 0 CA-C-N 116.044 -0.525 . . . . 0.0 113.818 -179.186 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.643 ' HE2' ' SD ' ' A' ' 46' ' ' MET . 2.8 tptm -77.46 -37.48 51.36 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 -178.048 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.644 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 45.7 mt -53.74 -57.0 6.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.007 -178.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.971 ' HA ' HD22 ' A' ' 28' ' ' LEU . 9.8 t -49.25 -40.25 33.41 Favored 'General case' 0 N--CA 1.457 -0.115 0 CA-C-O 121.006 0.432 . . . . 0.0 110.073 177.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.752 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -50.33 -68.68 1.33 Allowed Glycine 0 N--CA 1.45 -0.426 0 CA-C-N 115.572 -0.74 . . . . 0.0 112.927 179.635 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.643 ' SD ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.19 -46.4 75.85 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -178.5 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.526 HD12 ' HB2' ' B' ' 7' ' ' ASN . 2.8 mm? -80.23 7.29 9.72 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 111.698 0.259 . . . . 0.0 111.698 -179.063 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.631 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.23 -13.24 60.03 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.9 0.381 . . . . 0.0 110.637 179.585 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.546 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 3.3 mt-10 -78.3 19.28 0.46 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.484 178.252 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.864 HD11 ' NZ ' ' A' ' 68' ' ' LYS . 2.3 tt -83.12 163.5 2.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.02 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.685 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 3.6 m-20 -71.12 158.95 35.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.731 -179.418 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.771 ' HA ' HD23 ' A' ' 55' ' ' LEU . 4.8 m120 -88.41 -29.08 20.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.837 -0.619 . . . . 0.0 109.676 176.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.91 -30.36 62.55 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 177.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.685 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 0.4 OUTLIER -76.93 -29.2 55.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.522 178.675 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.771 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -59.32 -47.49 85.2 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.986 0.422 . . . . 0.0 110.364 179.777 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.444 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 1.3 tm? -60.7 -41.65 95.62 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.474 179.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.538 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 0.2 OUTLIER -61.69 -41.8 98.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.615 179.101 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.59 ' HE2' ' HA ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -62.09 -36.72 82.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.128 178.749 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.783 HD12 ' NE ' ' A' ' 27' ' ' ARG . 4.4 tt -71.09 -19.79 62.42 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.407 178.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.538 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 2.6 pt-20 -106.01 -2.46 22.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.148 -179.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.59 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 9.1 m -123.16 78.87 52.23 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.933 -179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -55.79 -36.47 95.31 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.124 1.883 . . . . 0.0 112.059 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.459 ' HG2' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.7 -46.6 18.68 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.883 -179.065 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.59 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 14.1 m -71.15 -50.46 33.18 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.952 0.406 . . . . 0.0 111.311 -178.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.976 HD21 HD13 ' A' ' 31' ' ' LEU . 0.0 OUTLIER -57.95 -56.9 16.05 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.874 -179.242 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.639 ' N ' HD13 ' A' ' 65' ' ' LEU . 2.2 ttm180 -51.56 -30.78 22.03 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.744 -178.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.502 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 5.9 t -69.66 -38.54 77.14 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.031 0.444 . . . . 0.0 110.327 178.322 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.864 ' NZ ' HD11 ' A' ' 50' ' ' ILE . 8.7 mtpp -65.41 -58.55 5.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.189 178.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.46 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 49.5 t -62.75 -21.58 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.616 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.502 ' HB3' ' O ' ' A' ' 67' ' ' SER . 13.4 t0 -54.46 -48.97 71.14 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 177.089 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.436 ' O ' HG13 ' A' ' 75' ' ' VAL . 21.6 tt0 -68.76 -32.62 72.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.602 176.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.644 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -58.29 -35.32 71.63 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.393 178.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.799 HG13 HG21 ' A' ' 38' ' ' THR . 25.3 t -67.0 -33.02 60.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.662 177.613 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.35 -38.01 71.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.123 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.58 HG22 ' O ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -56.78 -33.38 40.81 Favored 'Isoleucine or valine' 0 C--O 1.231 0.092 0 CA-C-O 121.187 0.517 . . . . 0.0 109.916 179.17 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.744 HD12 HG22 ' A' ' 38' ' ' THR . 2.9 tm? -69.37 -49.87 51.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.525 178.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -54.14 -35.44 62.23 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.601 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.0 -26.85 36.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.705 178.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 5.0 t60 . . . . . 0 C--N 1.332 -0.164 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.797 179.63 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 15.6 m120 . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.88 0.372 . . . . 0.0 110.702 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.439 ' HA ' HD12 ' B' ' 6' ' ' LEU . 3.3 tp -70.84 -83.23 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.601 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 7' ' ' ASN . . . . . 0.601 HD22 ' H ' ' B' ' 9' ' ' ASN . 1.6 t30 -76.02 134.43 71.35 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.694 178.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -79.87 -8.32 14.46 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 122.327 2.018 . . . . 0.0 112.305 179.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 9' ' ' ASN . . . . . 0.601 ' H ' HD22 ' B' ' 7' ' ' ASN . 73.9 m-20 -123.67 57.46 1.18 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.012 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.15 95.88 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.379 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.546 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -125.01 131.82 53.34 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.585 179.004 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -47.66 167.68 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 121.2 0.524 . . . . 0.0 112.301 -178.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' PHE . . . . . 0.752 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.6 OUTLIER . . . . . 0 C--N 1.332 -0.178 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.69 179.126 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.632 ' HG2' HE22 ' A' ' 20' ' ' GLN . 3.6 mttp . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.822 0.344 . . . . 0.0 110.84 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.405 ' HD1' ' HA ' ' B' ' 19' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.841 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.782 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 5.2 t . . . . . 0 CA--C 1.52 -0.186 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.14 -37.07 76.37 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 176.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 17.3 t -70.1 -35.92 74.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.566 177.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.782 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 8.7 mtm -64.43 -35.52 81.19 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.129 177.732 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.558 ' HA ' ' HE2' ' A' ' 23' ' ' MET . 44.7 mt -52.71 -50.19 63.85 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.915 179.054 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.18 -28.83 69.06 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.875 177.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -101.76 23.92 10.63 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.931 -178.537 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.637 ' HB1' ' CB ' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.33 -0.263 0 CA-C-O 120.626 0.251 . . . . 0.0 110.851 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.637 ' CB ' ' HB1' ' A' ' 15' ' ' ALA . 1.9 mm-40 . . . . . 0 N--CA 1.451 -0.421 0 CA-C-O 120.373 0.13 . . . . 0.0 111.086 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.516 ' O ' HD12 ' A' ' 24' ' ' LEU . 2.8 pp0? -46.9 -56.49 6.25 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.412 -177.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.448 ' HG2' ' NE2' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -56.15 -29.02 60.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.176 -179.163 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 14.9 tp60 -72.65 -73.86 0.19 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.483 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . 0.594 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.41 -97.87 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -176.926 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.686 HD22 ' HD3' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -62.22 3.65 0.17 Allowed 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -174.914 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.5 -118.7 13.22 Favored Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 108.274 -1.931 . . . . 0.0 108.274 -174.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.624 ' HG2' HG22 ' A' ' 50' ' ' ILE . 0.4 OUTLIER -75.59 -66.37 0.79 Allowed 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 106.962 -1.496 . . . . 0.0 106.962 168.105 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.686 ' HD3' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -159.81 5.99 0.09 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.009 -1.45 . . . . 0.0 108.0 174.164 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.902 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.4 OUTLIER -59.64 -77.62 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.271 -1.331 . . . . 0.0 114.354 -173.061 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.576 ' CD2' HG21 ' A' ' 44' ' ' THR . 0.1 OUTLIER -33.15 -48.45 0.61 Allowed Pre-proline 0 CA--C 1.539 0.538 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -174.636 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.586 ' HD3' ' HA ' ' A' ' 24' ' ' LEU . 19.2 Cg_endo -62.13 -43.45 24.09 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.22 1.947 . . . . 0.0 113.448 -178.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.805 HD13 HG21 ' A' ' 69' ' ' VAL . 0.0 OUTLIER -71.32 -44.62 64.77 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 119.816 -0.754 . . . . 0.0 109.984 -179.645 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.576 HD11 HD23 ' A' ' 28' ' ' LEU . 0.5 OUTLIER -72.23 -13.34 16.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 177.689 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.641 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 57.7 tp60 -62.53 -41.75 99.07 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 176.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.83 -28.03 68.03 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 175.085 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . 0.524 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 5.9 mtt -102.75 25.4 9.26 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.228 178.291 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.641 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 2.2 p-80 -64.39 -31.69 6.23 Favored Pre-proline 0 CA--C 1.536 0.421 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -176.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.561 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 51.8 Cg_exo -36.11 -31.74 0.1 OUTLIER 'Trans proline' 0 C--N 1.363 1.318 0 C-N-CA 122.125 1.884 . . . . 0.0 112.061 179.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.802 HG21 HG13 ' A' ' 73' ' ' VAL . 6.9 m -78.21 -88.92 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.578 176.144 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.616 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 7.7 tp -171.7 62.64 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.131 177.371 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.487 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -45.02 -41.2 7.22 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.544 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.526 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -52.17 -51.62 40.4 Favored Glycine 0 C--N 1.329 0.192 0 C-N-CA 121.172 -0.537 . . . . 0.0 113.587 -179.222 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.46 ' HA ' ' HD2' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -77.42 -40.44 43.49 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 122.719 -0.283 . . . . 0.0 111.68 -178.594 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.64 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 65.7 mt -53.7 -54.53 18.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.83 -179.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.902 ' HA ' HD22 ' A' ' 28' ' ' LEU . 11.4 t -53.47 -41.26 66.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.362 178.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.647 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -51.62 -67.45 1.99 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 121.009 -0.615 . . . . 0.0 112.85 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.557 ' HG3' HD22 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -55.35 -47.0 76.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.712 0.256 . . . . 0.0 111.575 -179.022 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.557 HD22 ' HG3' ' A' ' 46' ' ' MET . 3.1 mm? -80.28 8.23 7.85 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.625 0.231 . . . . 0.0 111.625 -179.216 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.647 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.1 OUTLIER -64.54 -13.26 51.81 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 121.017 0.437 . . . . 0.0 110.111 179.406 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.483 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.5 mt-10 -78.67 20.64 0.43 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.377 177.211 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.624 HG22 ' HG2' ' A' ' 26' ' ' GLU . 0.3 OUTLIER -83.26 157.03 3.79 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.672 -179.457 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.65 155.47 40.46 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.905 0.383 . . . . 0.0 111.745 -178.278 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.895 ' HA ' HD23 ' A' ' 55' ' ' LEU . 3.1 m120 -85.61 -28.98 24.45 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.06 177.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 62.6 m -74.19 -29.96 62.0 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.721 177.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.566 ' O ' ' HG2' ' A' ' 58' ' ' MET . 2.6 mm-40 -79.88 -29.39 39.96 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.638 179.062 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.895 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -58.99 -46.88 87.05 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.132 179.757 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.458 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 26.9 tp -62.16 -45.55 92.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.617 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -59.62 -28.49 67.26 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.17 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.629 ' SD ' ' HA ' ' A' ' 65' ' ' LEU . 32.1 mmt -69.51 -49.05 58.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.377 -179.375 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.528 ' HG ' ' CZ ' ' A' ' 27' ' ' ARG . 0.2 OUTLIER -64.38 -21.23 66.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.092 -179.576 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -96.38 -4.56 41.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.062 0.458 . . . . 0.0 110.41 178.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.58 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 11.9 m -124.18 78.39 59.96 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.803 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -55.79 -33.73 88.99 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.138 1.892 . . . . 0.0 112.146 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -78.13 -49.44 13.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.828 -179.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.58 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 39.2 m -69.45 -45.38 69.21 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.853 0.359 . . . . 0.0 111.444 -178.272 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.658 HD11 HD13 ' A' ' 31' ' ' LEU . 0.6 OUTLIER -57.92 -66.72 0.43 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.409 -178.835 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.65 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -47.06 -31.47 3.38 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.924 -178.884 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.529 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.5 OUTLIER -65.36 -44.27 88.18 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.164 0.507 . . . . 0.0 109.986 177.714 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.512 ' O ' HD11 ' B' ' 6' ' ' LEU . 0.2 OUTLIER -65.86 -59.85 3.45 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.555 178.791 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.805 HG21 HD13 ' A' ' 31' ' ' LEU . 78.8 t -61.05 -19.67 20.46 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.018 179.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.529 ' HB3' ' O ' ' A' ' 67' ' ' SER . 7.1 t70 -55.7 -49.42 73.06 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 176.174 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.458 ' O ' HG13 ' A' ' 75' ' ' VAL . 22.2 tt0 -66.12 -32.53 74.03 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.677 176.239 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.65 ' O ' HG22 ' A' ' 75' ' ' VAL . . . -57.74 -37.07 72.97 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.31 178.639 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.802 HG13 HG21 ' A' ' 38' ' ' THR . 24.6 t -65.04 -32.57 58.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.642 177.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.05 -36.62 66.93 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.205 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.65 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.85 -29.45 40.49 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.129 0 CA-C-O 121.02 0.438 . . . . 0.0 110.098 179.111 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.633 HD12 HG22 ' A' ' 38' ' ' THR . 2.6 tm? -70.34 -51.01 33.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.375 178.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -58.06 -35.54 71.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.457 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.27 -17.91 47.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.006 179.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.966 -179.896 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 5' ' ' ASN . . . . . 0.593 ' HB2' HG12 ' A' ' 75' ' ' VAL . 2.6 m-80 . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.682 0.277 . . . . 0.0 110.914 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.512 HD11 ' O ' ' A' ' 68' ' ' LYS . 3.4 mt -62.72 -80.18 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.583 179.572 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 7' ' ' ASN . . . . . 0.58 HD22 ' H ' ' B' ' 9' ' ' ASN . 2.7 t30 -75.02 142.34 75.95 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.556 178.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -78.98 -12.18 14.71 Favored 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.318 2.012 . . . . 0.0 112.122 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 9' ' ' ASN . . . . . 0.585 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 69.9 m-20 -123.96 60.72 1.11 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.163 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.86 96.11 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.616 179.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.585 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.0 OUTLIER -122.47 129.05 51.61 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.37 178.433 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -48.17 173.44 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.115 0.483 . . . . 0.0 112.126 -178.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' PHE . . . . . 0.483 ' CE1' ' HG ' ' A' ' 48' ' ' LEU . 0.3 OUTLIER . . . . . 0 CA--C 1.519 -0.248 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.867 179.393 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.474 ' HG2' ' NE2' ' A' ' 20' ' ' GLN . 7.6 mttt . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.89 0.376 . . . . 0.0 110.63 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 1.7 t80 . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.941 -179.324 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.849 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 10.8 t . . . . . 0 N--CA 1.457 -0.123 0 CA-C-O 120.647 0.26 . . . . 0.0 110.473 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.435 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.45 -37.2 77.55 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 176.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.3 t -70.56 -33.77 71.48 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.591 177.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.849 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.3 mtm -64.09 -35.74 81.75 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 177.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.559 HD11 ' HB3' ' A' ' 24' ' ' LEU . 1.7 mp -52.32 -54.27 33.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.02 178.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.31 -26.68 67.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.244 178.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.7 p -101.64 15.57 28.51 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.881 -178.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.674 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.329 -0.314 0 CA-C-O 120.583 0.23 . . . . 0.0 111.209 -179.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.674 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.804 0.335 . . . . 0.0 110.947 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.606 ' NE2' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -54.24 -65.47 0.57 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.265 -179.55 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.618 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -56.34 -19.59 15.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.733 -177.693 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.618 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 16.6 tp60 -72.72 -80.59 0.06 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.028 0.442 . . . . 0.0 111.322 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . 0.663 ' HE2' ' HB3' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -69.91 -95.41 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.658 -177.374 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.582 ' HB2' ' CG ' ' A' ' 30' ' ' PRO . 0.4 OUTLIER -62.46 -2.38 1.04 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -175.06 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.561 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 65.29 -116.35 8.71 Favored Glycine 0 N--CA 1.445 -0.763 0 N-CA-C 108.419 -1.872 . . . . 0.0 108.419 -173.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.65 -69.88 0.49 Allowed 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 169.407 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.699 ' HD2' ' HG2' ' A' ' 30' ' ' PRO . 12.8 tpt180 -160.11 14.33 0.13 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.325 -1.307 . . . . 0.0 107.951 175.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.556 ' O ' HG13 ' A' ' 32' ' ' ILE . 3.9 mm? -57.76 -76.2 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.423 -1.262 . . . . 0.0 113.329 -174.281 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.634 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -39.02 -47.11 3.68 Favored Pre-proline 0 CA--C 1.538 0.517 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -175.815 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.699 ' HG2' ' HD2' ' A' ' 27' ' ' ARG . 52.1 Cg_exo -57.36 -43.31 53.2 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.333 2.022 . . . . 0.0 113.817 -178.145 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.881 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.58 -47.44 60.24 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.395 0.617 . . . . 0.0 109.955 -178.488 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.771 HG21 HD12 ' A' ' 43' ' ' ILE . 0.7 OUTLIER -73.99 -13.15 15.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.227 178.468 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.647 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.2 OUTLIER -62.54 -40.85 98.1 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 176.834 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.13 -30.06 70.47 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 174.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . 0.486 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 6.6 mtt -101.69 25.93 7.96 Favored 'General case' 0 N--CA 1.461 0.09 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.443 178.199 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.647 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.8 p-80 -65.32 -32.87 6.85 Favored Pre-proline 0 CA--C 1.535 0.392 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 -177.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.573 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 57.3 Cg_exo -36.69 -33.01 0.13 Allowed 'Trans proline' 0 C--N 1.36 1.181 0 C-N-CA 122.183 1.922 . . . . 0.0 112.182 179.407 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.473 ' HB ' ' H ' ' A' ' 39' ' ' LEU . 1.1 m -79.06 -86.31 0.07 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.982 -0.553 . . . . 0.0 109.732 176.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.599 ' HB2' HD13 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -171.36 65.03 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.194 0 CA-C-O 120.719 0.295 . . . . 0.0 111.371 177.982 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.543 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -52.62 -29.1 24.24 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.127 179.165 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.62 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -49.49 -56.83 10.24 Favored Glycine 0 N--CA 1.452 -0.234 0 CA-C-N 115.805 -0.634 . . . . 0.0 114.053 -178.38 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.609 ' O ' ' HG2' ' A' ' 46' ' ' MET . 0.0 OUTLIER -77.93 -37.99 46.47 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -177.345 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.792 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 22.0 mt -53.18 -54.19 18.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 C-N-CA 120.952 -0.299 . . . . 0.0 111.562 -177.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.542 HG21 ' CD2' ' A' ' 29' ' ' PHE . 5.1 t -46.8 -49.46 19.89 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.44 ' N ' HG23 ' A' ' 44' ' ' THR . . . -55.16 -48.56 67.56 Favored Glycine 0 N--CA 1.449 -0.451 0 CA-C-N 115.878 -0.601 . . . . 0.0 112.796 178.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.716 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.2 OUTLIER -54.94 -69.78 0.12 Allowed 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.461 0.648 . . . . 0.0 111.066 -179.079 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.855 HD23 ' HB2' ' B' ' 7' ' ' ASN . 2.5 mp -80.03 17.64 0.96 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.832 -177.142 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.592 ' HB3' ' HD2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -65.98 -23.47 66.59 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 121.161 0.505 . . . . 0.0 109.755 177.009 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.547 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 1.2 mt-10 -74.58 23.46 0.09 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.01 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.625 HD11 ' HE3' ' A' ' 68' ' ' LYS . 3.5 tt -84.7 169.52 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.932 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.541 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 30.6 m-20 -70.96 159.59 34.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.615 -179.569 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.85 ' HA ' HD23 ' A' ' 55' ' ' LEU . 8.0 m120 -89.09 -28.31 20.19 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.897 177.232 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -74.05 -30.15 62.26 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 177.144 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.541 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 1.2 mm-40 -78.87 -28.77 44.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.656 178.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.85 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -59.18 -45.93 89.73 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.07 179.6 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.53 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 7.1 tt -60.1 -49.97 75.54 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.6 179.022 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -58.59 -32.05 68.61 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.284 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.565 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -62.85 -55.62 24.66 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.067 -179.77 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 56' ' ' LEU . 2.3 pp -66.14 -6.21 12.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.028 0.442 . . . . 0.0 110.369 178.62 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.522 ' HG3' ' O ' ' A' ' 60' ' ' GLU . 9.4 tp10 -105.12 -13.95 15.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.606 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.534 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -122.66 91.37 49.56 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.966 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.408 ' HD2' ' HA ' ' A' ' 61' ' ' SER . 32.2 Cg_endo -63.79 -31.25 68.57 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.303 2.002 . . . . 0.0 112.151 179.537 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.573 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.61 -45.44 21.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.15 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.573 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 19.1 m -72.73 -56.36 5.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.011 0.434 . . . . 0.0 111.537 -178.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.881 HD21 HD13 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -57.86 -60.69 3.32 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.621 -177.999 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.703 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -51.78 -35.41 43.72 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.22 -177.752 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.533 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 2.8 m -65.52 -37.76 87.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.102 0.477 . . . . 0.0 110.194 178.23 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.625 ' HE3' HD11 ' A' ' 50' ' ' ILE . 0.5 OUTLIER -66.39 -55.08 17.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.574 179.019 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.626 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 61.4 t -67.99 -16.14 20.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.564 179.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.588 ' O ' HG22 ' A' ' 73' ' ' VAL . 8.7 t70 -58.04 -49.46 76.8 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 176.101 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.529 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 0.4 OUTLIER -68.9 -20.07 64.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.734 176.354 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.792 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -65.63 -47.72 74.64 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.732 179.434 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.588 HG22 ' O ' ' A' ' 70' ' ' ASP . 2.4 m -57.17 -30.5 34.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 176.62 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.529 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -68.33 -32.18 72.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.837 178.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.682 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.2 m -60.81 -30.91 48.17 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.131 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 178.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.599 HD13 ' HB2' ' A' ' 39' ' ' LEU . 30.6 mt -67.82 -50.55 56.11 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.271 0.557 . . . . 0.0 109.602 176.276 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -51.53 -39.18 57.21 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.343 179.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.93 -25.11 35.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.848 177.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 . . . . . 0 C--N 1.332 -0.164 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.956 -179.557 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.457 -0.11 0 CA-C-O 120.852 0.358 . . . . 0.0 110.981 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.616 ' HB3' HD21 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -82.78 -79.0 0.2 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.818 179.678 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 7' ' ' ASN . . . . . 0.855 ' HB2' HD23 ' A' ' 47' ' ' LEU . 6.2 t30 -84.98 127.63 63.76 Favored Pre-proline 0 C--N 1.331 -0.219 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.129 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -80.17 13.48 2.19 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 122.357 2.038 . . . . 0.0 111.884 178.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 9' ' ' ASN . . . . . 0.526 ' HB3' ' OE2' ' A' ' 49' ' ' GLU . 25.8 m-20 -123.61 28.31 7.02 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.31 -179.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . 0.716 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -59.39 96.41 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.818 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.547 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 1.7 mttp -130.11 -178.4 4.72 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.473 178.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -68.87 161.34 28.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.658 0.266 . . . . 0.0 111.061 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' PHE . . . . . 0.407 ' HB2' ' CA ' ' A' ' 45' ' ' GLY . 1.0 OUTLIER . . . . . 0 C--O 1.232 0.173 0 CA-C-O 120.957 0.408 . . . . 0.0 110.697 179.427 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.58 ' HG2' HE22 ' A' ' 20' ' ' GLN . 24.0 mttp . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.813 0.339 . . . . 0.0 110.516 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.592 ' HD2' ' HB3' ' A' ' 48' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.983 -179.449 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.797 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 8.0 t . . . . . 0 CA--C 1.522 -0.112 0 CA-C-O 120.51 0.195 . . . . 0.0 110.718 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.471 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.55 -38.31 80.73 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 176.703 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.9 t -67.61 -35.04 78.21 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.459 -0.792 . . . . 0.0 109.347 176.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.797 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.7 mtm -64.42 -34.58 78.52 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.945 177.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.487 HD11 HD23 ' A' ' 24' ' ' LEU . 1.2 mp -54.88 -44.83 74.41 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.367 179.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.3 -37.18 84.82 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.884 178.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.28 47.02 0.92 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.989 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.77 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 CA--C 1.537 0.461 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -177.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.77 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 1.4 tp10 . . . . . 0 N--CA 1.461 0.089 0 CA-C-O 120.631 0.253 . . . . 0.0 110.838 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.614 ' NE2' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -46.88 -55.67 7.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.34 -178.386 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.722 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -56.26 -24.2 41.24 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.84 -178.571 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.558 ' H ' ' HD3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -72.54 -78.36 0.09 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.899 0.38 . . . . 0.0 111.862 -179.299 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . 0.563 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.29 -95.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -176.37 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.563 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -60.39 -0.23 0.23 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -175.353 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 65.18 -115.69 8.02 Favored Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 108.431 -1.868 . . . . 0.0 108.431 -174.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.589 ' HG2' HG22 ' A' ' 50' ' ' ILE . 0.5 OUTLIER -75.52 -70.11 0.45 Allowed 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 168.64 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.699 ' HB2' HD13 ' A' ' 55' ' ' LEU . 12.7 tpt85 -160.37 10.53 0.1 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.152 -1.385 . . . . 0.0 107.67 174.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.995 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -58.88 -72.62 0.1 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 114.236 -1.347 . . . . 0.0 113.778 -173.025 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.675 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -35.81 -49.31 1.48 Allowed Pre-proline 0 CA--C 1.538 0.503 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -176.134 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.508 ' O ' ' HB3' ' A' ' 33' ' ' GLN . 53.0 Cg_exo -58.69 -42.39 54.19 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.436 2.091 . . . . 0.0 113.633 -178.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.944 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.09 -47.64 61.03 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.07 0.462 . . . . 0.0 109.998 -178.559 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.882 HG21 HD12 ' A' ' 43' ' ' ILE . 0.5 OUTLIER -75.07 -12.06 14.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.199 178.258 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.613 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 50.3 tp60 -62.39 -39.23 92.54 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 177.174 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.58 -30.23 67.95 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.011 174.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . 0.582 ' HE1' ' HA ' ' A' ' 66' ' ' ARG . 6.7 mtt -100.55 28.25 5.22 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.333 178.116 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.613 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -64.96 -31.33 5.26 Favored Pre-proline 0 CA--C 1.536 0.433 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.324 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.593 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 55.7 Cg_exo -35.28 -33.03 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.265 0 C-N-CA 122.365 2.043 . . . . 0.0 112.535 179.549 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.402 ' N ' ' O ' ' A' ' 36' ' ' HIS . 67.8 m -78.18 -85.31 0.07 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.122 177.377 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.579 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.2 OUTLIER -171.19 50.85 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.547 179.014 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.484 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -37.02 -38.81 0.2 Allowed 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -179.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.675 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -44.23 -63.74 2.25 Favored Glycine 0 C--N 1.33 0.206 0 CA-C-N 115.998 -0.546 . . . . 0.0 114.208 -179.265 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.845 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.8 OUTLIER -77.48 -27.56 52.0 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.257 0.465 . . . . 0.0 112.257 -177.267 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.882 HD12 HG21 ' A' ' 32' ' ' ILE . 1.2 mt -54.01 -50.51 53.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.662 0.268 . . . . 0.0 111.195 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.995 ' HA ' HD22 ' A' ' 28' ' ' LEU . 10.6 t -55.4 -46.38 76.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.58 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.594 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -50.05 -59.38 7.58 Favored Glycine 0 N--CA 1.452 -0.253 0 CA-C-N 115.986 -0.552 . . . . 0.0 113.234 -179.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.522 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -56.89 -53.51 57.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.659 0.266 . . . . 0.0 111.371 -178.92 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.542 ' HB2' HD21 ' A' ' 28' ' ' LEU . 2.8 mm? -80.3 10.97 3.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.767 -178.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.594 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.48 -20.53 66.39 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.827 0.346 . . . . 0.0 110.613 179.711 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.536 ' HB2' ' ND2' ' B' ' 7' ' ' ASN . 2.2 mt-10 -76.0 21.54 0.17 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.793 179.222 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.589 HG22 ' HG2' ' A' ' 26' ' ' GLU . 0.2 OUTLIER -83.55 163.41 2.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.915 -179.669 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.493 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 1.3 m-20 -70.61 155.67 40.44 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.763 -178.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.873 ' HA ' HD23 ' A' ' 55' ' ' LEU . 5.4 m120 -84.87 -29.94 24.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.861 177.418 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.502 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 18.3 m -74.09 -28.49 61.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.298 0.57 . . . . 0.0 109.677 177.021 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.537 ' O ' ' HG2' ' A' ' 58' ' ' MET . 0.2 OUTLIER -80.16 -28.28 38.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.402 178.839 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.873 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.8 OUTLIER -59.7 -47.52 85.33 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.684 -179.699 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.533 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 1.0 OUTLIER -64.31 -43.24 95.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.725 179.955 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 9.1 m-70 -58.8 -21.83 56.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.118 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.638 ' HB3' ' HG ' ' A' ' 65' ' ' LEU . 28.2 mmt -76.59 -49.54 16.07 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.472 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.58 HD22 ' HE ' ' A' ' 27' ' ' ARG . 2.6 pp -66.14 -10.63 42.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.673 0.273 . . . . 0.0 110.895 -179.703 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -106.8 -5.52 18.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.707 178.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.6 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 3.6 m -122.52 81.83 47.14 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.946 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -58.49 -33.74 98.23 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.239 1.959 . . . . 0.0 111.83 179.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -78.51 -48.84 14.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.82 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.6 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 15.5 m -70.98 -53.36 15.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.888 0.375 . . . . 0.0 111.533 -177.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.944 HD21 HD13 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -58.01 -61.39 2.58 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.434 -178.405 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.681 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.8 OUTLIER -49.69 -34.54 18.89 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.141 -177.679 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 15.1 m -68.37 -39.18 81.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.248 0.547 . . . . 0.0 110.149 178.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.615 ' HE2' ' SD ' ' A' ' 58' ' ' MET . 0.2 OUTLIER -65.99 -56.35 12.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.552 179.201 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.544 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 21.0 t -63.87 -20.74 27.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.345 178.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.641 ' O ' HG22 ' A' ' 73' ' ' VAL . 21.4 t70 -53.88 -48.68 69.83 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 176.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.491 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 1.6 tt0 -68.28 -29.47 68.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.937 176.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.586 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -58.35 -47.22 84.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.001 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.843 ' HA ' HD13 ' A' ' 43' ' ' ILE . 2.0 m -58.84 -31.72 45.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 177.56 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -69.03 -39.39 79.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.3 179.711 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.545 HG12 ' HB2' ' B' ' 5' ' ' ASN . 0.9 OUTLIER -55.73 -29.74 25.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-O 120.948 0.404 . . . . 0.0 109.917 179.487 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.845 HD11 ' HB3' ' A' ' 42' ' ' LYS . 3.5 mm? -71.84 -51.01 24.58 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.338 177.341 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 -50.75 -34.76 28.46 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.223 -0.898 . . . . 0.0 110.004 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -82.0 -31.33 31.13 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.684 177.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 1.6 t60 . . . . . 0 C--N 1.333 -0.143 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.055 -179.68 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 5' ' ' ASN . . . . . 0.545 ' HB2' HG12 ' A' ' 75' ' ' VAL . 9.7 m120 . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.703 0.287 . . . . 0.0 111.015 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 14.2 mt -64.0 -76.51 0.07 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.765 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 7' ' ' ASN . . . . . 0.536 ' ND2' ' HB2' ' A' ' 49' ' ' GLU . 2.0 t30 -76.62 126.57 85.87 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.669 179.066 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.491 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 4.6 Cg_exo -74.61 -4.46 15.45 Favored 'Trans proline' 0 N--CA 1.46 -0.476 0 C-N-CA 122.307 2.005 . . . . 0.0 112.037 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 9' ' ' ASN . . . . . 0.416 ' H ' HD22 ' B' ' 7' ' ' ASN . 95.7 m-20 -123.65 54.8 1.28 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.022 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . 0.522 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.27 92.09 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.441 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.449 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 0.1 OUTLIER -109.47 165.76 11.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.628 179.137 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . 0.606 ' HG2' ' NZ ' ' A' ' 42' ' ' LYS . 1.8 tm-20 -67.85 165.07 18.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.65 179.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' PHE . . . . . 0.514 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.1 t80 . . . . . 0 C--N 1.33 -0.255 0 CA-C-O 120.978 0.418 . . . . 0.0 110.635 179.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.722 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.881 0.372 . . . . 0.0 110.725 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.932 -179.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.76 HG21 ' HB3' ' A' ' 29' ' ' PHE . 10.5 t . . . . . 0 N--CA 1.455 -0.179 0 CA-C-O 120.706 0.289 . . . . 0.0 110.382 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.36 -37.24 77.39 Favored 'General case' 0 N--CA 1.455 -0.225 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 177.201 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -70.72 -35.6 72.8 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.905 177.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.735 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 10.9 mtm -64.17 -36.85 85.42 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 177.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.66 HD11 ' HB3' ' A' ' 24' ' ' LEU . 1.4 mp -51.69 -52.43 48.31 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.975 179.047 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.45 -33.27 75.33 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.307 178.462 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.51 30.91 4.0 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.908 -178.118 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.451 ' HB1' ' CB ' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.331 -0.235 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.044 179.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.531 ' HA ' ' OE1' ' A' ' 19' ' ' GLU . 0.7 OUTLIER . . . . . 0 N--CA 1.453 -0.295 0 CA-C-O 120.668 0.271 . . . . 0.0 110.792 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.596 HE22 ' HB3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -46.73 -66.76 0.36 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.054 -0.521 . . . . 0.0 112.11 -177.568 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.733 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -56.74 -19.17 15.46 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -177.372 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.639 ' N ' ' HD2' ' A' ' 21' ' ' LYS . 1.8 tt0 -72.72 -78.05 0.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.911 0.386 . . . . 0.0 111.294 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . 0.626 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.47 -97.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.419 -177.074 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.66 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -61.79 -1.04 0.54 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -175.836 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 65.1 -115.84 8.21 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 108.463 -1.855 . . . . 0.0 108.463 -174.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.42 ' O ' HD13 ' A' ' 24' ' ' LEU . 0.4 OUTLIER -76.06 -69.54 0.49 Allowed 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 169.447 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.837 ' HG3' HD21 ' A' ' 31' ' ' LEU . 6.3 tpt180 -159.63 12.21 0.13 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 114.309 -1.314 . . . . 0.0 108.107 176.622 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.593 HD12 HD11 ' A' ' 32' ' ' ILE . 3.8 mm? -57.76 -84.14 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.44 -1.255 . . . . 0.0 113.923 -173.412 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.76 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -32.66 -51.53 0.61 Allowed Pre-proline 0 CA--C 1.535 0.392 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -174.977 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.57 ' HG2' ' O ' ' A' ' 27' ' ' ARG . 10.0 Cg_endo -56.03 -41.98 71.32 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.479 2.119 . . . . 0.0 113.787 -177.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.837 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.61 -48.81 53.27 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 120.019 -0.672 . . . . 0.0 109.748 -179.427 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.837 HG21 HD12 ' A' ' 43' ' ' ILE . 0.7 OUTLIER -72.17 -13.51 16.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.304 178.578 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.647 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 1.8 tp-100 -62.41 -40.01 95.15 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 177.312 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.71 -29.92 70.02 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.227 -0.897 . . . . 0.0 108.882 174.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . 0.471 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 6.8 mtt -101.65 25.61 8.3 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.399 177.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.8 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 0.1 OUTLIER -64.07 -32.76 8.09 Favored Pre-proline 0 CA--C 1.536 0.429 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 -177.271 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.8 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 4.0 Cg_exo -36.21 -32.74 0.11 Allowed 'Trans proline' 0 C--N 1.364 1.343 0 C-N-CA 122.498 2.132 . . . . 0.0 112.099 179.33 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 1.006 HG21 HG13 ' A' ' 73' ' ' VAL . 0.2 OUTLIER -78.23 -87.23 0.06 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.898 176.83 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.533 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.3 OUTLIER -171.29 59.97 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.371 178.388 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.503 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -48.64 -31.36 6.6 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 120.894 0.378 . . . . 0.0 111.309 179.475 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.647 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -44.43 -63.99 2.21 Favored Glycine 0 N--CA 1.453 -0.225 0 CA-C-N 115.684 -0.689 . . . . 0.0 114.372 -178.505 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.563 ' HE3' ' HG3' ' B' ' 12' ' ' GLU . 0.0 OUTLIER -77.79 -29.61 50.93 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -176.999 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.918 HD11 HD11 ' A' ' 76' ' ' LEU . 15.9 mt -53.88 -53.92 23.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.467 -178.622 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.555 HG21 ' CD2' ' A' ' 29' ' ' PHE . 6.7 t -47.14 -46.6 23.36 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.143 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.64 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -53.44 -61.06 7.37 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.917 -0.583 . . . . 0.0 113.022 179.304 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.575 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.45 -52.6 63.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.665 0.269 . . . . 0.0 111.492 -178.516 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.582 HD11 ' HB3' ' B' ' 6' ' ' LEU . 3.0 mm? -80.04 5.72 13.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.685 -178.327 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.474 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.0 -16.58 64.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.837 0.351 . . . . 0.0 110.717 179.57 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' B' ' 9' ' ' ASN . 3.4 mm-40 -76.65 18.84 0.3 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.807 179.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.43 ' H ' ' C ' ' A' ' 48' ' ' LEU . 0.4 OUTLIER -83.23 161.3 3.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.528 179.89 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.55 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 6.3 m-20 -70.49 155.51 40.61 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.98 0.419 . . . . 0.0 111.51 -178.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.887 ' HA ' HD23 ' A' ' 55' ' ' LEU . 5.1 m120 -83.33 -30.95 27.08 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.323 178.544 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.2 t -74.04 -33.7 63.82 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.302 0.572 . . . . 0.0 109.521 177.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.55 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -77.96 -24.93 47.95 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.552 179.445 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.887 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -60.28 -48.11 83.15 Favored 'General case' 0 C--O 1.231 0.121 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 178.461 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.431 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 2.0 tm? -58.71 -39.88 82.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.094 178.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.49 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 12.9 t-80 -60.19 -40.21 89.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.543 178.707 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.563 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -62.21 -41.65 98.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.073 0.463 . . . . 0.0 110.309 178.815 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.649 HD12 ' CZ ' ' A' ' 27' ' ' ARG . 8.1 tt -67.19 -19.51 65.58 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.7 178.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 57' ' ' HIS . 5.2 pt-20 -105.03 -6.6 19.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.52 -178.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.564 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.3 OUTLIER -123.0 86.79 50.94 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.139 -179.69 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.467 ' O ' ' HB2' ' A' ' 66' ' ' ARG . 23.9 Cg_endo -61.3 -30.13 87.3 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.18 1.92 . . . . 0.0 111.863 179.038 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -78.09 -51.13 10.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.436 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.415 ' O ' ' HB2' ' A' ' 67' ' ' SER . 66.9 m -69.83 -50.43 42.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.633 -178.307 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.827 HD21 HD13 ' A' ' 31' ' ' LEU . 0.0 OUTLIER -58.03 -59.77 4.75 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.282 -178.626 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.63 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -51.78 -30.27 22.31 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.618 -178.635 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.57 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 2.5 m -67.36 -37.71 83.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.314 178.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.459 ' HE3' ' OE2' ' A' ' 54' ' ' GLU . 3.2 mtmm -65.72 -59.33 4.02 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.164 178.516 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.567 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 74.9 t -62.75 -18.71 21.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.58 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.57 ' HB3' ' O ' ' A' ' 67' ' ' SER . 7.3 t70 -56.92 -48.82 77.35 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 176.2 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.41 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 43.8 tt0 -67.87 -29.31 68.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.628 176.24 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.805 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -59.27 -42.74 91.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.341 178.45 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 1.006 HG13 HG21 ' A' ' 38' ' ' THR . 14.6 t -60.73 -30.52 47.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 176.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -73.52 -31.88 63.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.056 178.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.73 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.1 m -61.0 -30.02 46.81 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.084 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 179.234 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.918 HD11 HD11 ' A' ' 43' ' ' ILE . 76.2 mt -65.94 -56.67 10.54 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 121.233 0.54 . . . . 0.0 109.942 177.227 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 21.2 mm100 -51.02 -36.11 37.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.026 -0.988 . . . . 0.0 110.591 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.81 -27.54 33.6 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.042 178.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 0.595 ' HB2' ' O ' ' A' ' 75' ' ' VAL . 0.9 OUTLIER . . . . . 0 C--N 1.331 -0.218 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.196 -179.337 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.726 0.298 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.582 ' HB3' HD11 ' A' ' 47' ' ' LEU . 9.7 tp -62.82 -81.36 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.769 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 7' ' ' ASN . . . . . 0.673 HD22 ' H ' ' B' ' 9' ' ' ASN . 1.3 t30 -78.75 130.03 71.92 Favored Pre-proline 0 C--N 1.332 -0.194 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.706 178.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.93 1.38 8.95 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.107 1.871 . . . . 0.0 112.108 179.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 9' ' ' ASN . . . . . 0.673 ' H ' HD22 ' B' ' 7' ' ' ASN . 17.2 m-80 -123.52 46.71 2.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.918 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . 0.575 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.27 95.82 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.573 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.425 ' HG3' ' O ' ' B' ' 9' ' ' ASN . 1.0 OUTLIER -121.49 170.46 9.64 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.502 178.949 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . 0.563 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 2.3 tt0 -68.06 163.8 21.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.795 0.331 . . . . 0.0 111.03 179.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 13' ' ' PHE . . . . . 0.64 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.2 t80 . . . . . 0 C--N 1.332 -0.185 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.152 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.733 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.064 0 CA-C-O 120.929 0.395 . . . . 0.0 110.954 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 2.4 t80 . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.004 -179.912 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.796 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 10.8 t . . . . . 0 N--CA 1.456 -0.157 0 CA-C-O 120.727 0.299 . . . . 0.0 110.521 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.517 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.46 -38.26 80.31 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 176.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 10.7 t -71.13 -34.35 70.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.608 177.184 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.796 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 5.3 mtm -64.36 -33.92 76.96 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 177.139 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.759 HD12 ' SD ' ' A' ' 23' ' ' MET . 3.7 mp -52.79 -54.66 30.89 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.891 178.421 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.32 -25.92 67.06 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.242 178.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.1 m -101.66 14.02 33.2 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.963 -178.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.632 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.33 -0.279 0 CA-C-O 120.515 0.198 . . . . 0.0 111.281 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.632 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.774 0.321 . . . . 0.0 110.92 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.486 ' O ' HD12 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -60.87 -49.44 77.48 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.354 179.626 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.566 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -56.88 -21.74 31.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.255 -179.82 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.566 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 12.5 tp60 -73.84 -80.49 0.07 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.035 0.445 . . . . 0.0 111.641 179.562 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . 0.759 ' SD ' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -70.05 -94.87 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -176.032 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.605 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -58.91 0.96 0.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -174.993 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.411 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . 64.83 -117.13 9.87 Favored Glycine 0 N--CA 1.444 -0.791 0 N-CA-C 108.342 -1.903 . . . . 0.0 108.342 -174.488 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' A' ' 51' ' ' ASP . 2.2 mp0 -76.06 -69.12 0.52 Allowed 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 169.083 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.846 ' HB2' HD13 ' A' ' 55' ' ' LEU . 1.7 tpt180 -159.99 9.27 0.1 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.259 -1.337 . . . . 0.0 107.939 175.065 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.969 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.59 -69.78 0.19 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 114.308 -1.315 . . . . 0.0 113.561 -173.61 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.588 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -37.93 -49.0 3.02 Favored Pre-proline 0 CA--C 1.538 0.503 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -175.847 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.599 ' HG2' ' HD2' ' A' ' 27' ' ' ARG . 46.5 Cg_exo -58.97 -43.89 39.52 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 122.37 2.046 . . . . 0.0 113.505 -178.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.609 HD13 ' CD1' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.89 -46.02 63.32 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.216 -178.313 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.852 HD11 HD23 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -74.96 -12.61 15.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.166 178.087 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.636 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -62.09 -39.77 93.57 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 176.557 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.46 -31.77 72.16 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.058 174.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . 0.518 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 6.4 mtt -100.23 27.42 5.66 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.394 178.185 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.636 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 2.0 p-80 -65.31 -31.99 5.8 Favored Pre-proline 0 CA--C 1.536 0.431 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 -177.383 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.581 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 47.5 Cg_exo -35.78 -32.53 0.1 OUTLIER 'Trans proline' 0 C--N 1.361 1.209 0 C-N-CA 122.278 1.985 . . . . 0.0 112.597 179.709 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.405 ' HB ' ' H ' ' A' ' 39' ' ' LEU . 16.9 m -78.28 -83.27 0.09 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.131 177.144 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.516 HD12 ' HB2' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -171.09 52.77 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.201 178.828 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.485 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -38.33 -42.54 0.72 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.97 -179.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.588 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -52.73 -49.44 53.62 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 121.046 -0.597 . . . . 0.0 113.641 -178.706 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.953 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.1 OUTLIER -77.05 -36.7 55.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 117.061 0.431 . . . . 0.0 111.616 -178.491 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.72 HD12 HG21 ' A' ' 32' ' ' ILE . 0.4 OUTLIER -53.63 -62.62 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.724 0.297 . . . . 0.0 110.721 -179.846 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.969 ' HA ' HD22 ' A' ' 28' ' ' LEU . 8.9 t -48.56 -44.11 36.26 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.261 178.622 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.881 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -48.12 -67.79 1.47 Allowed Glycine 0 C--O 1.227 -0.289 0 CA-C-N 115.655 -0.702 . . . . 0.0 113.201 179.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.501 ' HA ' ' C ' ' B' ' 11' ' ' LYS . 0.0 OUTLIER -54.68 -56.83 14.97 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.797 0.295 . . . . 0.0 111.797 -178.057 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.861 HD23 ' HB2' ' B' ' 7' ' ' ASN . 2.8 mp -79.99 17.42 0.98 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 -177.683 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.639 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.72 -18.09 65.19 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.121 0.486 . . . . 0.0 109.871 177.044 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.601 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.1 mt-10 -74.65 19.96 0.13 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.335 179.513 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.435 ' H ' ' C ' ' A' ' 48' ' ' LEU . 1.8 tt -83.29 162.74 3.11 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-O 120.828 0.347 . . . . 0.0 110.959 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.487 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 1.1 m-20 -71.18 154.73 41.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.102 -0.499 . . . . 0.0 112.288 -178.298 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.766 ' HA ' HD23 ' A' ' 55' ' ' LEU . 1.8 m120 -82.54 -27.39 31.68 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.551 176.192 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -74.19 -32.91 63.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.805 177.585 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.4 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 4.5 mt-10 -75.71 -28.7 58.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.419 178.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.846 HD13 ' HB2' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -59.84 -46.94 87.7 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.149 179.288 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.406 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -57.57 -48.6 78.89 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.505 179.255 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.405 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 0.3 OUTLIER -57.26 -40.12 77.01 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.865 179.776 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.565 ' SD ' ' HE2' ' A' ' 68' ' ' LYS . 12.9 mmt -64.41 -41.55 96.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.01 0.434 . . . . 0.0 110.294 179.104 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.454 HD12 ' NE ' ' A' ' 27' ' ' ARG . 4.9 tt -69.39 -14.99 63.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.78 179.712 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.405 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 0.0 OUTLIER -106.58 -9.12 16.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.35 -179.751 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.649 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -123.22 85.65 51.59 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.934 -179.678 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_endo -61.34 -33.1 89.76 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.295 1.997 . . . . 0.0 112.173 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.32 -46.36 20.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.463 -179.429 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 30.8 m -70.22 -48.39 57.26 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.859 0.361 . . . . 0.0 111.316 -178.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.65 ' HG ' ' N ' ' A' ' 66' ' ' ARG . 0.1 OUTLIER -58.01 -58.57 7.82 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.749 -178.937 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.65 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -50.9 -34.07 26.87 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.241 -177.625 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.54 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 35.3 t -63.41 -41.95 98.75 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.118 0.485 . . . . 0.0 110.153 178.246 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.565 ' HE2' ' SD ' ' A' ' 58' ' ' MET . 1.0 OUTLIER -66.21 -57.32 7.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.686 179.285 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.553 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 71.1 t -63.36 -19.08 23.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.775 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.638 ' O ' HG22 ' A' ' 73' ' ' VAL . 7.5 t70 -56.97 -48.85 77.42 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 176.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.518 ' HB3' HD12 ' B' ' 6' ' ' LEU . 0.8 OUTLIER -68.87 -25.54 64.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.843 176.56 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.688 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -61.18 -48.78 79.99 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.845 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.658 ' HA ' HD13 ' A' ' 43' ' ' ILE . 2.6 m -58.68 -30.14 41.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 177.334 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.51 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -69.08 -37.98 78.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.287 -0.869 . . . . 0.0 111.196 179.331 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.549 HG22 ' O ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -57.31 -29.02 31.8 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 178.664 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.953 HD11 ' HB3' ' A' ' 42' ' ' LYS . 3.9 mm? -72.0 -50.7 26.47 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.073 177.081 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -51.38 -31.25 21.73 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.241 -0.891 . . . . 0.0 109.697 178.294 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.47 -30.09 33.51 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.581 177.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 2.7 t-160 . . . . . 0 C--N 1.333 -0.12 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.636 179.332 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 4.1 m120 . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.74 0.305 . . . . 0.0 110.997 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.518 HD12 ' HB3' ' A' ' 71' ' ' GLU . 0.8 OUTLIER -80.62 -81.43 0.13 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.84 -179.982 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 7' ' ' ASN . . . . . 0.861 ' HB2' HD23 ' A' ' 47' ' ' LEU . 2.1 t30 -81.47 122.82 81.22 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.757 179.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -78.54 9.88 3.02 Favored 'Trans proline' 0 N--CA 1.459 -0.517 0 C-N-CA 122.16 1.906 . . . . 0.0 112.034 179.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 9' ' ' ASN . . . . . 0.519 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 56.5 m-20 -123.25 34.33 5.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.034 -179.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.77 90.01 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.654 -179.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.601 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 1.9 mttm -129.1 138.56 51.91 Favored 'General case' 0 C--O 1.226 -0.179 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.132 178.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -46.58 163.04 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -177.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 13' ' ' PHE . . . . . 0.881 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.7 OUTLIER . . . . . 0 N--CA 1.463 0.187 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.786 179.433 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.463 ' HG2' HE22 ' A' ' 20' ' ' GLN . 5.0 mttm . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.906 0.384 . . . . 0.0 110.825 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.466 ' HD1' ' HA ' ' B' ' 19' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.83 -179.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.794 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 8.2 t . . . . . 0 CA--C 1.521 -0.141 0 CA-C-O 120.704 0.288 . . . . 0.0 110.372 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.452 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.43 -39.24 82.87 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 176.418 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 39.3 t -68.94 -33.1 73.17 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.454 176.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.794 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.2 mtm -64.13 -34.86 79.01 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.818 177.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.502 HD11 ' HB3' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -55.25 -49.96 70.69 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.329 178.684 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.05 -32.41 73.86 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.611 178.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.1 m -101.38 46.67 0.93 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.76 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.845 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 CA--C 1.537 0.447 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 -178.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.845 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 2.1 tp10 . . . . . 0 N--CA 1.455 -0.203 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.464 ' HA ' HD11 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -46.25 -56.31 5.95 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.672 -177.512 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.519 ' H ' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -56.02 -24.3 38.37 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.506 -178.342 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.475 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 17.1 tp60 -73.6 -78.45 0.09 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.908 0.385 . . . . 0.0 111.838 179.398 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . 0.587 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -68.96 -97.29 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 112.997 0.74 . . . . 0.0 112.997 -175.93 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.587 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -57.03 0.34 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.275 0 N-CA-C 113.51 0.929 . . . . 0.0 113.51 -175.519 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.419 ' H ' ' C ' ' A' ' 23' ' ' MET . . . 64.79 -117.19 9.99 Favored Glycine 0 CA--C 1.505 -0.594 0 N-CA-C 108.269 -1.932 . . . . 0.0 108.269 -174.685 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.535 ' HG2' HG22 ' A' ' 50' ' ' ILE . 0.4 OUTLIER -75.56 -68.27 0.58 Allowed 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 168.089 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.832 ' HE ' HD13 ' A' ' 59' ' ' LEU . 1.1 tpt180 -160.52 8.42 0.09 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.151 -1.386 . . . . 0.0 107.999 174.37 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.955 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.23 -73.96 0.08 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.551 -1.204 . . . . 0.0 113.896 -172.921 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.578 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.2 OUTLIER -36.79 -49.79 1.99 Allowed Pre-proline 0 CA--C 1.536 0.431 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -175.336 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.602 ' HG2' ' O ' ' A' ' 27' ' ' ARG . 12.4 Cg_endo -58.95 -41.69 59.41 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 121.975 1.783 . . . . 0.0 113.128 -178.053 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.637 HD13 ' CD1' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -71.06 -45.44 63.79 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 120.339 -0.545 . . . . 0.0 110.182 -179.663 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.642 HD11 HD23 ' A' ' 28' ' ' LEU . 0.8 OUTLIER -71.56 -17.27 19.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.313 -0.403 . . . . 0.0 109.933 177.59 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.643 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 2.0 tt0 -63.26 -32.51 73.93 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 176.455 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.5 -29.64 65.04 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.679 -0.859 . . . . 0.0 108.679 175.02 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . 0.427 ' HE1' ' HB ' ' A' ' 69' ' ' VAL . 8.9 mtt -100.08 19.67 15.91 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 114.84 -1.073 . . . . 0.0 109.72 177.242 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.643 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.6 OUTLIER -63.81 -34.8 13.25 Favored Pre-proline 0 CA--C 1.532 0.263 0 CA-C-N 115.511 -0.768 . . . . 0.0 112.106 -178.636 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.542 ' CD ' ' N ' ' A' ' 36' ' ' HIS . 87.4 Cg_exo -42.18 -26.22 0.5 Allowed 'Trans proline' 0 C--N 1.361 1.191 0 C-N-CA 121.769 1.646 . . . . 0.0 111.066 177.323 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 1.081 HG21 HG13 ' A' ' 73' ' ' VAL . 86.8 m -77.99 -80.95 0.1 Allowed 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.325 -0.852 . . . . 0.0 109.556 176.089 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.612 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -171.63 52.51 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 112.608 0.595 . . . . 0.0 112.608 178.61 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -56.86 149.51 18.33 Favored 'General case' 0 C--O 1.231 0.127 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 176.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.578 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . 132.57 -73.41 0.46 Allowed Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.566 -178.364 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.56 -28.17 51.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.698 0.285 . . . . 0.0 111.043 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.627 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 55.2 mt -54.05 -53.77 25.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.795 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.955 ' HA ' HD22 ' A' ' 28' ' ' LEU . 13.1 t -54.25 -37.02 64.21 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.827 0.346 . . . . 0.0 110.538 178.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.857 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -48.12 -70.5 0.73 Allowed Glycine 0 N--CA 1.45 -0.418 0 CA-C-N 115.745 -0.661 . . . . 0.0 113.119 -179.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.473 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.36 -45.67 76.48 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -178.127 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.47 HD11 ' HB3' ' B' ' 6' ' ' LEU . 3.1 mm? -79.91 7.7 8.36 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -177.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.616 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.34 -7.38 18.6 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.881 0.372 . . . . 0.0 110.853 179.556 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.41 ' OE1' ' HG3' ' B' ' 11' ' ' LYS . 1.2 mm-40 -85.65 18.55 2.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.807 179.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.535 HG22 ' HG2' ' A' ' 26' ' ' GLU . 0.8 OUTLIER -83.72 162.63 3.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.861 -179.684 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.51 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 21.3 m-20 -70.96 157.58 37.95 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.902 0.382 . . . . 0.0 111.778 -178.506 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.928 ' HA ' HD23 ' A' ' 55' ' ' LEU . 3.1 m120 -87.07 -29.87 21.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.91 -0.587 . . . . 0.0 109.971 177.72 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.1 -30.51 62.37 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 177.094 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.51 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -78.38 -27.41 46.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.59 179.058 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.928 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.8 OUTLIER -61.6 -47.07 87.14 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.473 179.98 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 58.1 tp -61.9 -43.85 98.01 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.946 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -60.2 -28.48 68.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.443 -179.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.55 ' HB3' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -68.39 -51.07 48.13 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.529 -179.076 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.832 HD13 ' HE ' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -63.58 -20.24 65.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.194 -179.303 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -95.53 -5.84 41.84 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.02 0.438 . . . . 0.0 110.496 178.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.631 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 5.1 m -122.69 79.46 48.27 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.631 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -55.29 -34.57 88.95 Favored 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 122.36 2.04 . . . . 0.0 112.178 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -78.41 -49.34 13.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.945 -179.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.534 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 15.7 m -69.2 -45.96 68.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.961 0.41 . . . . 0.0 111.39 -178.029 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.637 ' CD1' HD13 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -59.46 -61.49 2.59 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.774 -178.558 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.627 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -50.78 -31.76 17.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.208 -177.538 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.531 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 20.7 t -63.86 -42.76 97.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.11 0.481 . . . . 0.0 110.276 178.346 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.404 ' HG2' HD21 ' B' ' 6' ' ' LEU . 6.3 ttmm -66.31 -58.12 6.01 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.853 179.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.478 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 79.3 t -62.37 -20.78 25.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.616 179.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.531 ' HB3' ' O ' ' A' ' 67' ' ' SER . 9.6 t0 -54.71 -49.08 71.59 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 176.343 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.507 ' HG2' ' HB3' ' B' ' 5' ' ' ASN . 0.5 OUTLIER -68.88 -29.48 67.79 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.847 176.495 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.627 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -60.44 -38.01 82.74 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.087 178.068 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 1.081 HG13 HG21 ' A' ' 38' ' ' THR . 3.6 t -64.74 -29.35 47.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 176.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.446 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -73.15 -38.94 66.06 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.251 179.375 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.568 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.07 -30.34 38.79 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-O 121.127 0.489 . . . . 0.0 110.086 179.343 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.612 ' HG ' ' HB3' ' A' ' 39' ' ' LEU . 3.0 tm? -71.19 -52.78 17.18 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.209 178.689 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -55.99 -34.52 65.85 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.614 179.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.01 -23.04 38.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.787 179.045 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 0.428 ' HB2' ' O ' ' A' ' 75' ' ' VAL . 19.3 t60 . . . . . 0 C--N 1.331 -0.229 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.86 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 5' ' ' ASN . . . . . 0.507 ' HB3' ' HG2' ' A' ' 71' ' ' GLU . 1.8 m-80 . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.753 0.311 . . . . 0.0 110.923 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.47 ' HB3' HD11 ' A' ' 47' ' ' LEU . 0.2 OUTLIER -71.27 -84.52 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.685 179.806 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -78.41 139.11 59.38 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.851 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -79.01 -9.21 15.5 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 122.328 2.018 . . . . 0.0 111.94 178.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 72.7 m-80 -123.31 57.79 1.14 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.79 179.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . 0.473 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -59.76 93.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.603 -179.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.41 ' HG3' ' OE1' ' A' ' 49' ' ' GLU . 10.2 mttp -114.02 125.19 53.71 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.337 179.038 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -48.74 168.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -177.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 13' ' ' PHE . . . . . 0.857 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.142 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.07 179.159 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.939 0.4 . . . . 0.0 110.674 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.008 -179.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.774 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 10.2 t . . . . . 0 CA--C 1.521 -0.135 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.466 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.48 -37.48 78.35 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 176.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.2 t -68.0 -34.73 77.08 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.739 177.307 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.774 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 12.0 mtm -64.21 -36.49 84.25 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.912 177.577 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.692 ' HA ' ' HE2' ' A' ' 23' ' ' MET . 4.1 mp -52.15 -48.68 64.77 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.117 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.03 -30.89 71.5 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.022 178.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.5 p -101.37 19.5 17.66 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.54 -178.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.579 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.21 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.579 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.9 OUTLIER . . . . . 0 N--CA 1.457 -0.114 0 CA-C-O 120.807 0.337 . . . . 0.0 110.83 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.477 ' O ' HD12 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -52.18 -57.61 9.11 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.372 -179.77 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.538 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.9 -20.37 15.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.539 -178.608 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.568 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 5.0 tp60 -73.2 -79.46 0.08 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.873 0.368 . . . . 0.0 111.341 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . 0.692 ' HE2' ' HA ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.87 -94.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -176.682 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.59 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -60.88 1.94 0.13 Allowed 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 113.682 0.993 . . . . 0.0 113.682 -174.876 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.86 -117.01 9.63 Favored Glycine 0 N--CA 1.445 -0.759 0 N-CA-C 108.359 -1.896 . . . . 0.0 108.359 -174.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.565 ' HG2' HG22 ' A' ' 50' ' ' ILE . 0.3 OUTLIER -75.49 -68.51 0.56 Allowed 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 107.24 -1.392 . . . . 0.0 107.24 168.572 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.872 ' HG2' HD12 ' A' ' 59' ' ' LEU . 3.6 tpt85 -160.34 9.37 0.1 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.303 -1.317 . . . . 0.0 108.223 174.643 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.966 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.3 OUTLIER -58.73 -72.89 0.09 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 114.407 -1.27 . . . . 0.0 113.893 -173.244 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.647 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -36.01 -49.0 1.57 Allowed Pre-proline 0 CA--C 1.539 0.546 0 N-CA-C 113.318 0.858 . . . . 0.0 113.318 -175.454 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.538 ' O ' ' HB3' ' A' ' 33' ' ' GLN . 51.4 Cg_exo -59.39 -42.12 51.86 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.39 2.06 . . . . 0.0 113.573 -178.72 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.847 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.52 -46.84 62.87 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 120.458 -0.497 . . . . 0.0 109.987 -178.627 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.614 HD11 HD23 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -74.57 -12.95 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.589 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.056 177.913 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.667 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 1.1 tt0 -62.46 -39.19 92.58 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 176.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.85 -30.5 69.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.432 -0.804 . . . . 0.0 108.881 174.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . 0.53 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 7.4 mtt -100.3 26.0 7.02 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.254 177.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.667 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.7 p-80 -64.98 -32.22 6.37 Favored Pre-proline 0 CA--C 1.536 0.418 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -177.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.614 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 42.8 Cg_exo -33.65 -35.47 0.08 OUTLIER 'Trans proline' 0 C--N 1.365 1.405 0 C-N-CA 122.288 1.992 . . . . 0.0 112.133 179.212 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.486 ' HB ' ' H ' ' A' ' 39' ' ' LEU . 2.7 m -78.1 -88.87 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.458 175.877 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.531 ' HB3' ' CD1' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -171.79 66.6 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.723 -0.217 . . . . 0.0 111.399 177.668 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.521 ' HB1' ' HB ' ' A' ' 32' ' ' ILE . . . -48.13 -32.67 7.21 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.565 179.561 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.647 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -46.41 -60.26 4.8 Favored Glycine 0 CA--C 1.518 0.256 0 CA-C-N 115.988 -0.551 . . . . 0.0 114.384 -178.283 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.858 ' HE3' ' HG3' ' B' ' 12' ' ' GLU . 4.4 tptm -77.27 -33.23 55.91 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.938 0.369 . . . . 0.0 111.943 -177.364 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.602 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 29.9 mt -54.01 -57.67 5.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.739 -0.21 . . . . 0.0 111.062 -179.212 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.966 ' HA ' HD22 ' A' ' 28' ' ' LEU . 9.3 t -50.16 -42.61 51.31 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.889 0.376 . . . . 0.0 110.244 178.58 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.89 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -49.35 -67.13 1.88 Allowed Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.681 -0.691 . . . . 0.0 113.296 -179.822 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.724 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.4 -47.26 76.16 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.74 0.27 . . . . 0.0 111.488 -178.157 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.445 ' O ' ' HB ' ' A' ' 50' ' ' ILE . 3.0 mm? -79.87 6.07 12.1 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -178.538 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.594 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.94 -10.58 40.3 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.915 0.388 . . . . 0.0 110.507 179.836 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.447 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 1.6 mm-40 -82.37 21.36 0.95 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.232 177.458 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.613 HD11 ' HE3' ' A' ' 68' ' ' LYS . 0.4 OUTLIER -83.53 160.73 3.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.991 -179.377 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.481 ' HB2' ' HG3' ' A' ' 54' ' ' GLU . 0.9 OUTLIER -70.87 156.61 39.36 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.658 -178.835 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.922 ' HA ' HD23 ' A' ' 55' ' ' LEU . 4.6 m120 -85.85 -27.87 24.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.197 178.037 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.82 -34.32 64.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.153 0.501 . . . . 0.0 109.769 177.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.539 ' O ' ' HG2' ' A' ' 58' ' ' MET . 4.5 mt-10 -76.43 -29.22 56.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.79 179.187 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.922 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -58.98 -45.92 89.39 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.959 0.409 . . . . 0.0 109.961 179.495 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.548 ' HA ' HD11 ' A' ' 59' ' ' LEU . 0.4 OUTLIER -60.25 -44.35 95.34 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.668 179.453 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -64.96 -13.68 58.05 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.057 179.626 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.687 ' SD ' ' HE2' ' A' ' 68' ' ' LYS . 31.7 mmt -76.29 -56.91 4.21 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.466 -179.691 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.872 HD12 ' HG2' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -67.1 -8.57 31.69 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 121.105 0.479 . . . . 0.0 110.429 178.927 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.541 ' N ' HD22 ' A' ' 59' ' ' LEU . 1.1 tp10 -98.61 -16.42 19.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.502 179.188 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.511 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 1.2 t -122.71 87.97 49.94 Favored Pre-proline 0 C--N 1.332 -0.153 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.373 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -60.22 -31.57 93.24 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.345 2.03 . . . . 0.0 111.89 179.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.462 ' O ' ' HB2' ' A' ' 67' ' ' SER . 6.9 mm-40 -77.87 -50.34 12.45 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.475 -179.693 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 67.8 m -69.38 -53.31 20.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.444 -178.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.847 HD21 HD13 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -57.99 -62.56 1.72 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.645 -178.177 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.679 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -49.93 -35.68 24.83 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.022 -177.639 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.506 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.2 OUTLIER -69.59 -36.14 75.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.159 0.504 . . . . 0.0 110.048 178.046 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.813 ' HG2' HD21 ' B' ' 6' ' ' LEU . 0.1 OUTLIER -66.4 -53.88 30.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.659 179.248 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.559 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 40.0 t -68.05 -19.08 24.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.317 178.537 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.694 ' O ' HG22 ' A' ' 73' ' ' VAL . 19.4 t0 -55.68 -48.75 74.54 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 176.596 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.522 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 1.2 tp10 -69.05 -26.34 64.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.739 176.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.602 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -60.78 -47.94 84.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.924 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.694 HG22 ' O ' ' A' ' 70' ' ' ASP . 4.9 m -60.2 -28.33 41.41 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.156 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 177.108 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.522 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -71.43 -30.26 65.85 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.133 178.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.599 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -69.12 -36.16 71.99 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 CA-C-O 120.812 0.339 . . . . 0.0 110.476 179.592 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.646 HD12 ' HB3' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -71.73 -56.32 6.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.939 179.782 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.444 ' HG3' ' O ' ' A' ' 74' ' ' ALA . 0.0 OUTLIER -52.41 -36.66 54.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.134 0.492 . . . . 0.0 110.332 179.794 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.8 -24.38 38.58 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.756 178.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 0.431 ' HB2' ' O ' ' A' ' 75' ' ' VAL . 77.2 t60 . . . . . 0 C--N 1.332 -0.185 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.727 179.605 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 49.1 m-80 . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.716 0.294 . . . . 0.0 111.32 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.813 HD21 ' HG2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -62.57 -73.34 0.11 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.006 -179.394 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 7' ' ' ASN . . . . . 0.601 HD22 ' H ' ' B' ' 9' ' ' ASN . 1.4 t30 -90.5 128.78 47.48 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.186 -179.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -77.79 -1.07 11.25 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.259 1.972 . . . . 0.0 111.798 178.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 9' ' ' ASN . . . . . 0.601 ' H ' HD22 ' B' ' 7' ' ' ASN . 26.6 m120 -123.41 52.12 1.43 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.682 179.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . 0.724 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.41 98.25 0.06 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.892 -179.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.582 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 2.7 mmtm -121.97 141.32 51.44 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.54 178.344 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . 0.858 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 17.2 mp0 -50.24 162.4 0.22 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.948 0.404 . . . . 0.0 111.999 -179.058 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 13' ' ' PHE . . . . . 0.89 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.9 OUTLIER . . . . . 0 CA--C 1.52 -0.206 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.614 177.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.902 0.382 . . . . 0.0 110.808 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.36 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.983 -179.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.767 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 8.9 t . . . . . 0 CA--C 1.521 -0.138 0 CA-C-O 120.614 0.245 . . . . 0.0 110.503 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.406 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.32 -39.4 82.97 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 176.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 10.9 t -69.69 -33.63 72.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.763 177.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.767 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.4 mtm -64.29 -37.04 86.08 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 116.169 -0.469 . . . . 0.0 109.888 177.726 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.761 HD11 ' HB3' ' A' ' 24' ' ' LEU . 1.4 mp -52.0 -51.83 54.66 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.205 179.125 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.22 -31.92 73.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.441 178.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.57 23.61 10.93 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.343 -0.39 . . . . 0.0 112.002 -178.137 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.601 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.329 -0.305 0 CA-C-O 120.555 0.217 . . . . 0.0 111.285 179.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.69 ' HG3' ' HB3' ' A' ' 22' ' ' GLN . 5.8 tp10 . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.683 0.278 . . . . 0.0 111.074 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.447 ' NE2' ' HG2' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -52.05 -58.36 6.76 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.387 -179.908 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.576 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.93 -21.81 22.67 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.543 -178.242 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.69 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 20.8 tp60 -73.39 -80.27 0.07 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.992 0.425 . . . . 0.0 111.654 179.683 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . 0.626 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.62 -94.94 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -176.7 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.761 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -59.96 -1.34 0.28 Allowed 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 -174.819 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.577 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 65.06 -116.93 9.47 Favored Glycine 0 N--CA 1.446 -0.648 0 N-CA-C 108.501 -1.84 . . . . 0.0 108.501 -174.54 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.465 ' HB3' ' HB2' ' A' ' 55' ' ' LEU . 0.7 OUTLIER -76.2 -67.23 0.7 Allowed 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 169.592 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.849 ' HG3' HD21 ' A' ' 31' ' ' LEU . 6.5 tpt180 -159.65 7.06 0.1 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.247 -1.342 . . . . 0.0 108.06 175.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.92 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.3 OUTLIER -59.19 -78.06 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.441 -1.254 . . . . 0.0 114.26 -172.906 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.615 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -32.88 -48.84 0.58 Allowed Pre-proline 0 CA--C 1.541 0.601 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -175.099 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.592 ' CD ' ' HB2' ' A' ' 24' ' ' LEU . 20.1 Cg_endo -63.44 -39.33 37.31 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.336 2.024 . . . . 0.0 113.817 -178.107 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 1.001 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.44 -45.48 65.72 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 119.997 -0.681 . . . . 0.0 109.506 179.981 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.511 HD11 HD23 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -73.46 -13.29 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.688 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.698 177.46 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.652 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -62.52 -38.1 88.63 Favored 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 177.213 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.41 -28.98 65.49 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 174.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . 0.57 ' HE2' HH11 ' A' ' 66' ' ' ARG . 7.8 mtt -100.16 25.61 7.32 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.087 177.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.652 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -64.62 -31.49 5.75 Favored Pre-proline 0 CA--C 1.536 0.422 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 -177.471 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.611 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 35.7 Cg_exo -33.31 -34.98 0.07 OUTLIER 'Trans proline' 0 C--N 1.364 1.352 0 C-N-CA 122.339 2.026 . . . . 0.0 112.034 178.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.492 ' HB ' ' H ' ' A' ' 39' ' ' LEU . 0.2 OUTLIER -78.01 -90.99 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 175.383 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.492 ' H ' ' HB ' ' A' ' 38' ' ' THR . 0.1 OUTLIER -171.88 67.07 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.649 -0.251 . . . . 0.0 111.307 177.163 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.536 ' HA ' HD12 ' A' ' 43' ' ' ILE . . . -46.38 -28.74 1.43 Allowed 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.922 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.615 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -50.45 -62.08 5.43 Favored Glycine 0 CA--C 1.518 0.27 0 CA-C-N 116.172 -0.467 . . . . 0.0 113.941 -178.375 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.558 ' HE3' ' HG3' ' B' ' 12' ' ' GLU . 4.6 tptm -74.95 -33.71 61.96 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.021 0.378 . . . . 0.0 112.021 -177.299 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.655 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 30.5 mt -54.36 -57.37 6.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.432 -178.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.92 ' HA ' HD22 ' A' ' 28' ' ' LEU . 9.0 t -51.2 -45.52 61.88 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.898 0.38 . . . . 0.0 110.519 178.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.624 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -49.66 -64.8 3.2 Favored Glycine 0 N--CA 1.451 -0.311 0 CA-C-N 115.689 -0.687 . . . . 0.0 113.282 -179.452 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.541 ' HB2' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.64 -47.57 76.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.83 0.315 . . . . 0.0 111.79 -178.374 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.418 HD22 ' HG3' ' A' ' 46' ' ' MET . 3.5 mm? -80.18 6.58 11.35 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.649 0.24 . . . . 0.0 111.649 -178.733 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.624 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.17 -7.01 15.4 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.989 0.423 . . . . 0.0 110.77 179.897 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.434 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 3.2 mt-10 -81.67 16.85 1.61 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.295 177.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -83.1 160.78 3.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.112 -179.187 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.464 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 1.5 m-20 -71.11 158.17 36.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.805 -178.765 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.821 ' HA ' HD23 ' A' ' 55' ' ' LEU . 3.9 m120 -86.69 -28.97 22.8 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.841 177.431 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.75 -32.62 63.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.37 0.605 . . . . 0.0 109.519 177.08 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.464 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -75.7 -28.59 58.66 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.564 179.168 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.821 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -60.52 -47.22 87.12 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.002 0.429 . . . . 0.0 110.348 179.533 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.451 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 52.1 tp -58.1 -43.69 87.23 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.555 179.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.475 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 1.7 t-80 -59.37 -41.29 88.98 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.67 179.122 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.543 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -61.21 -38.68 87.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.353 178.933 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.555 HD12 ' CZ ' ' A' ' 27' ' ' ARG . 7.3 tt -68.11 -20.36 64.92 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.349 178.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.475 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 2.2 pt-20 -107.02 -2.62 20.92 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.458 -179.274 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.581 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 15.9 m -122.52 88.37 49.42 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.251 -178.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -62.19 -31.96 82.72 Favored 'Trans proline' 0 C--N 1.343 0.258 0 C-N-CA 122.1 1.867 . . . . 0.0 111.688 178.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.564 ' O ' ' HB2' ' A' ' 67' ' ' SER . 5.0 mt-10 -78.45 -50.44 11.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.765 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.9 t -69.17 -52.38 28.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.082 0.468 . . . . 0.0 111.424 -178.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 1.001 HD21 HD13 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -58.13 -64.3 0.96 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.62 -177.882 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.624 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -51.13 -35.04 33.6 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.195 -177.553 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.564 ' HB2' ' O ' ' A' ' 63' ' ' GLU . 0.2 OUTLIER -69.7 -36.41 75.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.9 0.381 . . . . 0.0 110.315 178.428 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -66.32 -56.45 11.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.318 179.005 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.558 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 45.3 t -64.56 -21.07 28.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.492 179.039 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.662 ' O ' HG22 ' A' ' 73' ' ' VAL . 26.7 t70 -56.35 -48.4 76.87 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 176.713 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.473 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 0.8 OUTLIER -68.9 -26.76 65.26 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.751 176.449 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.655 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -60.58 -46.62 89.54 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.527 -0.761 . . . . 0.0 111.07 179.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.662 HG22 ' O ' ' A' ' 70' ' ' ASP . 3.6 m -61.24 -29.5 45.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 177.392 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.473 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -70.32 -28.41 65.14 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.151 179.248 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.581 HG22 ' O ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -69.87 -36.58 70.06 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.171 0 CA-C-O 120.811 0.338 . . . . 0.0 110.571 179.544 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.481 ' CD1' ' HB3' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -71.49 -53.99 12.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.134 -179.917 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.469 ' HG3' ' O ' ' A' ' 74' ' ' ALA . 0.0 OUTLIER -52.58 -37.97 59.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.272 0.558 . . . . 0.0 110.283 -179.965 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.11 -21.9 42.73 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.762 178.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 0.456 ' HB2' ' O ' ' A' ' 75' ' ' VAL . 31.7 t60 . . . . . 0 C--N 1.332 -0.163 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.133 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.83 0.347 . . . . 0.0 110.706 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 7.9 mt -66.7 -69.11 0.33 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.459 179.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 7' ' ' ASN . . . . . 0.551 HD22 ' H ' ' B' ' 9' ' ' ASN . 1.2 t30 -94.68 129.38 36.46 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.961 179.115 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.494 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 3.6 Cg_exo -76.49 -4.8 15.46 Favored 'Trans proline' 0 N--CA 1.462 -0.358 0 C-N-CA 122.563 2.175 . . . . 0.0 112.344 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 9' ' ' ASN . . . . . 0.551 ' H ' HD22 ' B' ' 7' ' ' ASN . 72.2 m-20 -123.61 48.7 1.82 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.986 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . 0.541 ' HB1' ' HB2' ' A' ' 46' ' ' MET . . . -55.44 97.19 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.616 -179.399 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.542 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -122.71 134.07 54.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.039 178.975 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . 0.558 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 11.5 tt0 -49.17 173.22 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -177.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 13' ' ' PHE . . . . . 0.505 ' CE1' ' HG ' ' A' ' 48' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.52 -0.184 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.712 179.005 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.447 ' HG2' ' NE2' ' A' ' 20' ' ' GLN . 15.9 mttt . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.85 0.357 . . . . 0.0 110.857 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.542 ' CE2' ' HG2' ' B' ' 11' ' ' LYS . 1.1 t80 . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.994 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.774 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 15.0 t . . . . . 0 N--CA 1.455 -0.206 0 CA-C-O 120.597 0.237 . . . . 0.0 110.399 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.24 -35.65 74.04 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 176.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 40.7 t -72.91 -34.29 66.52 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.894 177.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.774 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 10.6 mtm -64.15 -35.86 82.17 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.804 177.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.704 ' HA ' ' HE2' ' A' ' 23' ' ' MET . 5.6 mp -52.9 -55.63 21.83 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.995 178.273 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.9 -24.73 66.9 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.686 178.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.7 m -101.52 25.07 8.82 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.477 -179.222 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.74 ' HB1' ' HB2' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.889 179.678 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.74 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 2.8 mm-40 . . . . . 0 N--CA 1.448 -0.526 0 CA-C-O 120.472 0.177 . . . . 0.0 111.015 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.454 ' O ' HD12 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -46.35 -64.51 0.74 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.894 0.378 . . . . 0.0 110.997 -179.039 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.531 ' H ' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -56.49 -23.14 37.31 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.313 -179.512 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.502 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 2.7 tp60 -73.47 -75.98 0.14 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.771 0.32 . . . . 0.0 111.538 179.555 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . 0.704 ' HE2' ' HA ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -68.99 -96.58 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 112.613 0.598 . . . . 0.0 112.613 -176.332 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.648 HD22 ' HD3' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -62.13 3.08 0.19 Allowed 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -175.309 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.49 -117.28 10.29 Favored Glycine 0 N--CA 1.445 -0.761 0 N-CA-C 108.258 -1.937 . . . . 0.0 108.258 -174.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.526 ' O ' HD13 ' A' ' 24' ' ' LEU . 0.4 OUTLIER -75.49 -69.34 0.49 Allowed 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 168.609 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.787 ' NE ' HD12 ' A' ' 59' ' ' LEU . 9.9 tpt85 -160.44 10.08 0.1 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.188 -1.369 . . . . 0.0 107.768 174.164 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.951 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.09 -71.62 0.12 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 114.549 -1.205 . . . . 0.0 113.728 -173.14 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.639 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -36.28 -48.92 1.69 Allowed Pre-proline 0 CA--C 1.54 0.583 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -176.24 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.656 ' HB2' ' NH1' ' A' ' 27' ' ' ARG . 42.6 Cg_exo -61.4 -41.12 43.35 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 122.511 2.141 . . . . 0.0 113.874 -178.174 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.907 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -69.98 -45.94 66.25 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.359 0.6 . . . . 0.0 109.556 -179.094 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.826 HD11 HD23 ' A' ' 28' ' ' LEU . 0.7 OUTLIER -75.96 -12.09 14.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.021 177.381 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.639 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 3.5 tp-100 -62.44 -38.86 91.4 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.315 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.76 -31.22 70.11 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 174.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . 0.499 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 5.7 mtt -100.23 27.35 5.72 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.261 178.121 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.639 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -64.92 -32.71 7.04 Favored Pre-proline 0 CA--C 1.536 0.405 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -177.171 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.554 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 61.5 Cg_exo -37.12 -30.39 0.11 Allowed 'Trans proline' 0 C--N 1.36 1.178 0 C-N-CA 122.187 1.925 . . . . 0.0 112.36 179.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.848 HG21 HG13 ' A' ' 73' ' ' VAL . 37.2 m -78.65 -84.62 0.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.183 177.42 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.452 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.4 OUTLIER -171.12 49.84 0.03 OUTLIER 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.39 179.219 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.471 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -38.23 -38.11 0.33 Allowed 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.378 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.639 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -51.29 -55.49 19.11 Favored Glycine 0 CA--C 1.518 0.226 0 C-N-CA 121.248 -0.501 . . . . 0.0 113.789 -179.185 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.828 ' HB3' HD11 ' A' ' 76' ' ' LEU . 3.5 tptm -77.18 -32.21 55.94 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -177.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.8 HD12 HG21 ' A' ' 32' ' ' ILE . 0.5 OUTLIER -54.96 -56.55 10.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.121 -179.255 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.951 ' HA ' HD22 ' A' ' 28' ' ' LEU . 11.8 t -51.37 -44.52 62.13 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.616 179.566 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.763 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -48.63 -68.86 1.13 Allowed Glycine 0 C--O 1.227 -0.297 0 CA-C-N 115.917 -0.583 . . . . 0.0 113.321 -179.376 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.605 ' SD ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.41 -46.76 76.61 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -178.192 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.412 HD22 ' N ' ' A' ' 47' ' ' LEU . 3.4 mm? -80.31 7.93 8.53 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -178.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.634 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.94 -13.97 60.71 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.86 0.362 . . . . 0.0 110.767 179.894 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.544 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.0 mt-10 -78.6 19.18 0.5 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.731 178.629 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.764 HD11 ' NZ ' ' A' ' 68' ' ' LYS . 1.2 tt -83.22 163.97 2.84 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.982 -179.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.476 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 1.8 m-20 -71.25 156.37 39.62 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.836 -179.108 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.831 ' HA ' HD23 ' A' ' 55' ' ' LEU . 3.2 m120 -87.12 -28.21 22.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.75 176.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.7 m -74.14 -30.99 62.55 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 176.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.476 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.6 OUTLIER -75.4 -31.17 60.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.31 178.926 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.831 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.5 OUTLIER -59.28 -45.98 89.77 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.404 179.845 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.468 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 38.6 tp -58.8 -44.24 90.72 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.817 179.438 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.466 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 4.6 m80 -65.04 -38.73 91.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.126 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.563 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -60.62 -38.02 83.34 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.101 0.477 . . . . 0.0 110.14 178.828 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.787 HD12 ' NE ' ' A' ' 27' ' ' ARG . 7.6 tt -69.61 -20.25 63.63 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.411 178.837 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 57' ' ' HIS . 4.3 pt-20 -106.91 -1.45 22.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.517 -179.34 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.594 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 5.9 m -122.95 78.91 50.52 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.223 -179.556 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.452 ' O ' ' HB2' ' A' ' 66' ' ' ARG . 50.5 Cg_exo -55.69 -33.19 86.67 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.243 1.962 . . . . 0.0 111.993 179.408 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -78.21 -50.39 12.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.824 -179.363 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.594 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 50.2 m -70.43 -51.35 30.04 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.92 0.391 . . . . 0.0 111.535 -177.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.907 HD21 HD13 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -57.81 -59.33 5.39 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.282 -178.658 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.645 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -52.51 -30.46 30.41 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.796 -178.379 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.539 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.4 OUTLIER -69.44 -38.33 77.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.106 0.479 . . . . 0.0 110.134 178.005 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.764 ' NZ ' HD11 ' A' ' 50' ' ' ILE . 5.7 mtpp -65.65 -59.01 4.38 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.287 178.661 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.515 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 52.8 t -61.73 -21.53 26.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.606 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.539 ' HB3' ' O ' ' A' ' 67' ' ' SER . 16.2 t70 -54.79 -49.45 70.93 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -68.84 -30.51 69.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.766 176.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.675 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -57.7 -40.57 79.82 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.105 177.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.848 HG13 HG21 ' A' ' 38' ' ' THR . 33.4 t -62.21 -31.11 50.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.526 176.759 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.3 -37.14 66.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.53 179.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.516 HG22 ' O ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -58.71 -28.17 36.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.963 0.411 . . . . 0.0 110.159 179.782 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.828 HD11 ' HB3' ' A' ' 42' ' ' LYS . 3.1 mm? -71.35 -53.72 13.2 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.876 178.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 20.8 mm100 -51.16 -35.44 35.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.372 179.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.56 -26.92 34.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.877 178.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 6.3 t60 . . . . . 0 C--N 1.332 -0.186 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.162 -179.514 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 27.5 m-20 . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.809 0.338 . . . . 0.0 110.816 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.18 -85.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.827 179.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 7' ' ' ASN . . . . . 0.46 ' ND2' ' HB2' ' A' ' 49' ' ' GLU . 1.5 t30 -74.46 124.29 89.72 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.816 179.571 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -76.59 -0.74 10.77 Favored 'Trans proline' 0 N--CA 1.463 -0.316 0 C-N-CA 122.138 1.892 . . . . 0.0 111.81 179.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 9' ' ' ASN . . . . . 0.417 ' H ' HD22 ' B' ' 7' ' ' ASN . 23.4 m120 -123.12 51.15 1.47 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.57 179.437 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . 0.412 ' HB1' ' HB2' ' A' ' 46' ' ' MET . . . -60.06 97.91 0.05 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.627 -179.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.544 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 2.8 mttp -122.85 138.09 54.75 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.498 178.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . 0.628 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 4.9 mp0 -48.43 166.03 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.026 0.441 . . . . 0.0 112.13 -178.841 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 13' ' ' PHE . . . . . 0.763 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.8 OUTLIER . . . . . 0 C--N 1.332 -0.174 0 CA-C-N 115.87 -0.604 . . . . 0.0 109.699 178.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.93 0.395 . . . . 0.0 110.775 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.023 -179.28 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.732 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 3.0 t . . . . . 0 CA--C 1.521 -0.155 0 CA-C-O 120.566 0.222 . . . . 0.0 110.624 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.49 -34.92 69.57 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 177.533 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.3 t -72.22 -36.76 69.23 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.947 177.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.732 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 3.4 mtm -64.59 -37.56 87.99 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.422 178.248 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.792 HD21 ' HB3' ' A' ' 24' ' ' LEU . 65.1 mt -52.76 -50.38 63.62 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.946 179.37 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.39 -26.02 67.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.816 177.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.4 m -101.67 15.19 29.7 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.667 -178.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.946 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 CA--C 1.533 0.323 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.745 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.946 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 15.7 tp10 . . . . . 0 N--CA 1.456 -0.142 0 CA-C-O 120.773 0.32 . . . . 0.0 110.594 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.592 ' HG2' ' N ' ' A' ' 21' ' ' LYS . 0.1 OUTLIER -50.87 -51.12 54.66 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.326 -179.151 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.592 ' N ' ' HG2' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -56.37 -26.55 53.29 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.514 -178.327 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.799 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 2.5 tp-100 -73.42 -76.65 0.12 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.92 0.391 . . . . 0.0 111.702 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . 0.651 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -68.99 -97.73 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -176.492 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.792 ' HB3' HD21 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -59.05 -1.37 0.17 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -176.014 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.526 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 65.06 -118.17 11.69 Favored Glycine 0 N--CA 1.442 -0.901 0 N-CA-C 108.524 -1.83 . . . . 0.0 108.524 -174.764 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.475 ' HG2' HG22 ' A' ' 50' ' ' ILE . 0.4 OUTLIER -76.34 -67.07 0.73 Allowed 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 169.737 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.852 ' HG3' HD21 ' A' ' 31' ' ' LEU . 9.5 tpt180 -160.03 10.11 0.11 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 114.507 -1.224 . . . . 0.0 108.403 177.031 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.502 HD12 HD11 ' A' ' 32' ' ' ILE . 4.2 mm? -57.89 -82.41 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.72 -1.127 . . . . 0.0 113.795 -173.005 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.705 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -33.68 -50.0 0.79 Allowed Pre-proline 0 CA--C 1.537 0.471 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -175.071 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.606 ' CD ' ' HB2' ' A' ' 24' ' ' LEU . 12.2 Cg_endo -58.77 -40.6 71.19 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.415 2.076 . . . . 0.0 113.722 -177.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.852 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.52 -47.73 59.01 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 120.077 -0.649 . . . . 0.0 109.79 -179.666 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.522 ' O ' ' HB2' ' A' ' 40' ' ' ALA . 0.3 OUTLIER -73.31 -14.1 16.51 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.156 178.647 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.627 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 55.0 tp60 -62.15 -38.64 89.78 Favored 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 177.016 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.9 -31.1 70.64 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.063 174.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . 0.541 ' HE1' ' HA ' ' A' ' 66' ' ' ARG . 7.0 mtt -101.24 27.54 6.1 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.317 178.062 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.627 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 2.4 p-80 -64.37 -31.91 6.54 Favored Pre-proline 0 CA--C 1.537 0.458 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 -177.306 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.605 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 49.2 Cg_exo -34.71 -34.96 0.1 OUTLIER 'Trans proline' 0 C--N 1.362 1.257 0 C-N-CA 122.29 1.994 . . . . 0.0 112.411 179.399 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.482 HG22 HD12 ' A' ' 76' ' ' LEU . 31.9 m -78.3 -86.52 0.06 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.189 -0.459 . . . . 0.0 109.869 176.765 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.714 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -171.36 62.32 0.03 OUTLIER 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.364 178.406 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.522 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -48.44 -33.29 9.04 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.784 0.326 . . . . 0.0 111.578 179.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.648 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -45.26 -59.41 4.62 Favored Glycine 0 CA--C 1.518 0.24 0 CA-C-N 115.841 -0.618 . . . . 0.0 114.169 -178.262 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.866 ' HZ1' ' HA ' ' B' ' 12' ' ' GLU . 0.1 OUTLIER -78.26 -36.13 47.21 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.332 0.494 . . . . 0.0 112.332 -177.622 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.642 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 20.9 mt -53.06 -53.71 20.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.4 -177.657 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.586 HG21 ' CD2' ' A' ' 29' ' ' PHE . 5.1 t -47.9 -43.04 28.48 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-O 121.153 0.502 . . . . 0.0 109.786 177.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.889 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -51.78 -66.38 2.6 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.167 -0.924 . . . . 0.0 113.656 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.641 ' SD ' ' HE3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.33 -47.45 75.64 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -177.225 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.444 HD22 ' N ' ' A' ' 47' ' ' LEU . 3.3 mm? -79.98 3.46 20.0 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 121.145 -0.222 . . . . 0.0 111.564 -178.852 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.526 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.13 -11.6 50.17 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.842 0.354 . . . . 0.0 110.913 179.991 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.421 ' OE1' ' HG3' ' B' ' 11' ' ' LYS . 1.3 mm-40 -77.85 16.36 0.72 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.967 0.413 . . . . 0.0 110.554 178.309 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.488 HD11 ' NZ ' ' A' ' 68' ' ' LYS . 0.3 OUTLIER -83.77 158.77 3.64 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.048 -179.496 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.4 ' O ' HG23 ' A' ' 50' ' ' ILE . 2.2 m-20 -71.25 161.7 30.66 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.817 -179.111 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.926 ' HA ' HD23 ' A' ' 55' ' ' LEU . 1.8 m120 -83.92 -28.6 27.75 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.125 177.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.3 t -73.85 -36.67 64.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.081 -0.508 . . . . 0.0 109.961 178.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.426 ' HG2' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -75.71 -23.77 56.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.656 179.548 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.926 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -62.61 -47.15 85.02 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 120.916 0.389 . . . . 0.0 109.967 178.939 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.408 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 38.5 tp -58.12 -43.68 87.33 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.526 179.099 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.519 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 0.4 OUTLIER -57.76 -42.09 83.31 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.804 179.257 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.632 ' SD ' ' HE2' ' A' ' 68' ' ' LYS . 19.9 mmt -60.23 -44.08 95.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.072 0.463 . . . . 0.0 110.329 178.528 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.494 HD22 ' NE ' ' A' ' 27' ' ' ARG . 8.4 tp -68.46 -16.29 63.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.777 179.513 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.519 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 0.1 OUTLIER -106.81 0.32 23.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.95 179.51 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.629 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 5.5 m -125.66 82.7 63.29 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.121 -179.591 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -58.32 -35.28 98.87 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.217 1.945 . . . . 0.0 111.935 179.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.463 ' O ' ' HB2' ' A' ' 67' ' ' SER . 31.6 mt-10 -78.3 -47.79 17.06 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.887 -179.21 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.629 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 36.9 m -71.7 -53.12 14.52 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.815 0.34 . . . . 0.0 111.709 -177.779 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.81 HD21 HD13 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -57.94 -62.11 2.05 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.302 -178.476 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.675 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.6 OUTLIER -50.14 -34.05 20.94 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.861 -178.086 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.479 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.5 OUTLIER -69.6 -38.05 77.15 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.105 0.478 . . . . 0.0 110.228 177.806 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.725 ' HG2' HD22 ' B' ' 6' ' ' LEU . 0.2 OUTLIER -65.96 -58.2 6.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.316 178.938 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.542 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 28.0 t -62.99 -18.99 22.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.509 179.037 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.68 ' O ' HG22 ' A' ' 73' ' ' VAL . 25.1 t0 -56.14 -49.1 74.88 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 176.374 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.491 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 0.5 OUTLIER -69.08 -24.71 64.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.765 176.481 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.642 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -63.91 -43.85 94.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.811 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.68 HG22 ' O ' ' A' ' 70' ' ' ASP . 2.5 m -61.35 -29.93 46.95 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 177.15 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -68.41 -38.33 81.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.103 178.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.618 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.15 -35.44 52.9 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-O 120.995 0.426 . . . . 0.0 110.042 179.221 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.714 ' HG ' ' HB3' ' A' ' 39' ' ' LEU . 2.6 tm? -69.26 -47.06 65.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.065 178.487 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -54.25 -37.26 64.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.652 179.54 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.24 -23.95 37.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.784 178.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 16.0 t-160 . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.992 -179.884 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 24.1 m-20 . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.793 0.33 . . . . 0.0 110.876 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.725 HD22 ' HG2' ' A' ' 68' ' ' LYS . 11.9 mt -66.07 -89.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.765 179.72 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 7' ' ' ASN . . . . . 0.565 HD22 ' H ' ' B' ' 9' ' ' ASN . 0.6 OUTLIER -77.47 119.75 78.7 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.955 179.299 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 9.8 Cg_exo -72.34 0.26 7.66 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.344 2.029 . . . . 0.0 111.953 179.416 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 9' ' ' ASN . . . . . 0.565 ' H ' HD22 ' B' ' 7' ' ' ASN . 17.4 m-80 -123.01 45.55 2.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.605 179.494 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . 0.639 ' HB1' ' HB2' ' A' ' 46' ' ' MET . . . -59.49 98.45 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.505 -179.377 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.4 OUTLIER -117.25 138.16 51.91 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.666 179.185 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . 0.866 ' HA ' ' HZ1' ' A' ' 42' ' ' LYS . 0.4 OUTLIER -50.89 160.82 0.42 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.159 -0.473 . . . . 0.0 112.127 -178.758 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 13' ' ' PHE . . . . . 0.889 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.7 OUTLIER . . . . . 0 N--CA 1.463 0.179 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.472 177.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.415 ' HG2' ' NE2' ' A' ' 20' ' ' GLN . 12.4 mttm . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.894 0.378 . . . . 0.0 110.93 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.458 ' HD1' ' HA ' ' B' ' 19' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.842 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.742 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 5.2 t . . . . . 0 CA--C 1.522 -0.125 0 CA-C-O 120.746 0.308 . . . . 0.0 110.35 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.4 -37.68 78.62 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 176.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.3 t -66.96 -35.36 79.8 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.805 177.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.742 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.5 mtm -64.46 -38.52 91.3 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.19 178.155 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.93 HD21 ' HB3' ' A' ' 24' ' ' LEU . 49.0 mt -52.29 -44.56 65.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.342 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.27 -34.3 77.68 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.96 178.288 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.4 m -101.75 18.49 20.31 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.676 -179.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.513 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.089 -179.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.513 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.4 OUTLIER . . . . . 0 N--CA 1.455 -0.216 0 CA-C-O 120.592 0.234 . . . . 0.0 110.879 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.665 ' HG2' ' N ' ' A' ' 21' ' ' LYS . 1.6 pm0 -48.64 -51.9 25.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.905 -176.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.686 ' HD2' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -59.97 -23.29 63.48 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.567 -0.453 . . . . 0.0 111.692 -177.586 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.686 ' N ' ' HD2' ' A' ' 21' ' ' LYS . 5.2 tt0 -73.5 -78.97 0.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.041 0.448 . . . . 0.0 111.682 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . 0.698 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.66 -96.22 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -175.898 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.93 ' HB3' HD21 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -60.77 -2.17 0.51 Allowed 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -174.931 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.68 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.65 -116.52 9.11 Favored Glycine 0 N--CA 1.447 -0.576 0 N-CA-C 108.449 -1.861 . . . . 0.0 108.449 -174.488 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.761 ' HG2' HG22 ' A' ' 50' ' ' ILE . 0.3 OUTLIER -76.28 -68.56 0.57 Allowed 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 168.646 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.871 ' HE ' HD13 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -159.92 9.03 0.1 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.176 -1.374 . . . . 0.0 108.022 174.445 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.982 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.03 -74.39 0.07 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.139 -1.391 . . . . 0.0 113.896 -172.982 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.658 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -35.38 -49.14 1.26 Allowed Pre-proline 0 CA--C 1.538 0.504 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -175.646 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.576 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 52.0 Cg_exo -58.83 -43.35 44.55 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 122.316 2.011 . . . . 0.0 113.648 -178.722 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.779 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.54 -47.2 61.52 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 120.269 -0.572 . . . . 0.0 110.002 -178.509 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.836 HG21 HD12 ' A' ' 43' ' ' ILE . 0.6 OUTLIER -73.43 -12.93 15.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.909 178.073 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.602 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.7 OUTLIER -62.19 -38.54 89.51 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 177.147 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.56 -31.4 70.58 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.039 174.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . 0.518 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 6.6 mtt -100.84 27.99 5.55 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.228 178.061 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.602 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 3.7 p-80 -64.9 -31.69 5.77 Favored Pre-proline 0 CA--C 1.536 0.407 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 -177.232 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.554 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 63.0 Cg_exo -37.75 -29.97 0.13 Allowed 'Trans proline' 0 C--N 1.362 1.286 0 C-N-CA 122.137 1.891 . . . . 0.0 112.278 179.236 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.809 HG21 HG13 ' A' ' 73' ' ' VAL . 6.4 m -78.14 -86.11 0.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.04 177.137 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.495 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.3 OUTLIER -171.39 50.52 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.488 -0.323 . . . . 0.0 111.246 178.642 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.44 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -37.78 -36.84 0.2 Allowed 'General case' 0 N--CA 1.467 0.413 0 O-C-N 123.312 0.382 . . . . 0.0 111.92 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.658 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.34 -60.1 5.97 Favored Glycine 0 C--N 1.329 0.173 0 CA-C-N 116.042 -0.526 . . . . 0.0 113.821 -179.409 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.556 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -77.32 -30.47 54.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.983 0.392 . . . . 0.0 111.989 -177.681 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.836 HD12 HG21 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -54.0 -54.95 16.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 C-N-CA 121.077 -0.249 . . . . 0.0 111.155 -179.281 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.982 ' HA ' HD22 ' A' ' 28' ' ' LEU . 10.7 t -51.56 -47.57 63.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.628 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.577 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -49.8 -59.76 7.08 Favored Glycine 0 CA--C 1.518 0.264 0 C-N-CA 121.161 -0.543 . . . . 0.0 113.309 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.549 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -56.32 -53.79 53.08 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.788 0.294 . . . . 0.0 111.475 -178.731 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.581 ' HB2' HD21 ' A' ' 28' ' ' LEU . 2.9 mm? -80.02 10.19 4.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.819 -178.414 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.577 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.99 -17.62 64.8 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.872 0.368 . . . . 0.0 110.731 179.602 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.486 ' HB2' ' ND2' ' B' ' 7' ' ' ASN . 2.0 mm-40 -74.79 17.74 0.2 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.862 179.465 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.761 HG22 ' HG2' ' A' ' 26' ' ' GLU . 0.1 OUTLIER -83.98 160.08 3.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.88 -179.977 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.493 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 1.5 m-20 -70.71 156.82 39.01 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -178.334 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.958 ' HA ' HD23 ' A' ' 55' ' ' LEU . 2.2 m120 -84.21 -29.62 26.41 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.237 178.153 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.9 m -74.22 -35.18 63.88 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.422 0.629 . . . . 0.0 109.594 177.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.493 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -76.58 -21.6 55.39 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.688 179.657 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.958 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.9 OUTLIER -65.66 -47.54 75.16 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-O 121.001 0.429 . . . . 0.0 110.04 178.782 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.431 ' N ' HD12 ' A' ' 55' ' ' LEU . 2.7 tt -56.18 -44.31 79.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.685 179.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -56.61 -39.65 73.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.568 -179.503 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.527 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -57.36 -52.82 63.81 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -178.815 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.871 HD13 ' HE ' ' A' ' 27' ' ' ARG . 0.5 OUTLIER -61.53 -19.69 62.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.736 0.303 . . . . 0.0 111.171 -179.364 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -102.57 -6.22 23.05 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.603 178.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.555 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 52.4 m -122.72 81.76 48.65 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.729 -179.757 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.43 ' O ' ' HB2' ' A' ' 66' ' ' ARG . 19.6 Cg_endo -58.01 -30.57 90.45 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.338 2.026 . . . . 0.0 112.189 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -78.4 -50.5 11.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.954 -179.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.436 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 73.1 m -74.6 -29.67 61.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.967 -177.539 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.779 HD21 HD13 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -78.68 -60.03 2.54 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.006 -178.329 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.704 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -53.6 -31.72 48.13 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.636 -0.425 . . . . 0.0 110.539 -178.674 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.487 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 3.0 m -67.82 -36.53 80.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.096 177.687 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.495 ' HE2' ' HE2' ' A' ' 58' ' ' MET . 0.3 OUTLIER -65.31 -60.1 3.35 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.973 178.399 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.48 ' CG1' HG23 ' A' ' 32' ' ' ILE . 69.5 t -64.16 -19.71 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.731 -179.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.487 ' HB3' ' O ' ' A' ' 67' ' ' SER . 10.9 t70 -55.25 -50.67 68.89 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 176.84 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.442 ' O ' HG13 ' A' ' 75' ' ' VAL . 0.4 OUTLIER -69.22 -30.69 68.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.773 176.777 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.705 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -57.29 -42.41 81.64 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.307 178.299 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.809 HG13 HG21 ' A' ' 38' ' ' THR . 20.9 t -61.8 -31.12 50.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 176.888 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.417 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -73.51 -37.0 65.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.54 179.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.565 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.64 -27.81 35.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-O 120.95 0.405 . . . . 0.0 110.207 179.803 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.582 HD21 HG12 ' A' ' 43' ' ' ILE . 3.0 mm? -71.68 -54.85 9.01 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.639 178.526 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 64.3 mm-40 -51.18 -33.23 26.31 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.372 179.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.28 -32.76 33.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.745 178.24 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 71.2 t60 . . . . . 0 C--N 1.331 -0.207 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.873 179.976 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 5' ' ' ASN . . . . . 0.413 ' HB2' ' HG2' ' A' ' 71' ' ' GLU . 25.7 m120 . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.802 0.334 . . . . 0.0 110.847 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.3 mt -73.11 -78.5 0.09 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.678 179.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 7' ' ' ASN . . . . . 0.619 HD22 ' H ' ' B' ' 9' ' ' ASN . 0.8 OUTLIER -84.0 125.18 73.42 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.022 179.815 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -77.78 0.54 9.73 Favored 'Trans proline' 0 N--CA 1.461 -0.406 0 C-N-CA 122.195 1.93 . . . . 0.0 112.038 178.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 9' ' ' ASN . . . . . 0.619 ' H ' HD22 ' B' ' 7' ' ' ASN . 55.9 m-80 -123.44 49.63 1.68 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.796 179.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . 0.549 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.66 97.57 0.06 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.576 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.485 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 0.3 OUTLIER -117.41 167.71 11.02 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.478 178.559 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -67.25 167.93 11.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.691 0.281 . . . . 0.0 110.86 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 13' ' ' PHE . . . . . 0.432 ' CZ ' HD21 ' A' ' 48' ' ' LEU . 1.0 OUTLIER . . . . . 0 C--N 1.332 -0.169 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.855 -179.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.645 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 3.4 mttt . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.77 0.319 . . . . 0.0 110.842 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.95 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.805 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 5.0 t . . . . . 0 CA--C 1.52 -0.182 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.45 ' HB2' ' OE1' ' A' ' 33' ' ' GLN . . . -59.39 -40.8 87.75 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 176.607 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 37.4 t -67.8 -34.6 77.09 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.555 177.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.805 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.7 mtm -64.37 -39.3 93.6 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.264 177.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.813 HD21 ' HB3' ' A' ' 24' ' ' LEU . 45.5 mt -52.3 -45.67 65.63 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.274 -179.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.15 -34.04 77.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.994 178.305 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 37.3 m -101.87 21.65 14.27 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.594 -178.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.574 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.33 -0.253 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.159 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.574 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.71 0.291 . . . . 0.0 110.756 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.8 HE22 ' HB3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -48.19 -62.88 1.26 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.347 -179.735 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.755 ' HG3' HE21 ' A' ' 20' ' ' GLN . 0.0 OUTLIER -55.7 -23.37 28.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.703 -178.103 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.507 ' H ' ' HD3' ' A' ' 21' ' ' LYS . 15.8 tt0 -73.08 -79.15 0.08 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.894 0.378 . . . . 0.0 111.766 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . 0.647 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.46 -95.9 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -176.602 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.813 ' HB3' HD21 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -59.77 -1.56 0.28 Allowed 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -175.428 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.587 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 65.08 -116.05 8.45 Favored Glycine 0 N--CA 1.445 -0.733 0 N-CA-C 108.548 -1.821 . . . . 0.0 108.548 -174.374 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.85 -68.51 0.57 Allowed 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 168.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.847 ' HB2' HD13 ' A' ' 55' ' ' LEU . 10.7 tpt180 -159.89 7.69 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 114.136 -1.393 . . . . 0.0 107.794 175.332 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.793 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -60.71 -71.98 0.12 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.236 -1.347 . . . . 0.0 113.93 -173.414 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.64 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -35.5 -48.12 1.24 Allowed Pre-proline 0 CA--C 1.541 0.603 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -175.926 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.61 ' CD ' ' HB2' ' A' ' 24' ' ' LEU . 20.9 Cg_endo -64.18 -39.11 32.39 Favored 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 122.201 1.934 . . . . 0.0 113.573 -178.027 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 1.02 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.14 -45.92 65.83 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.764 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.74 HG21 HD12 ' A' ' 43' ' ' ILE . 0.6 OUTLIER -74.24 -13.72 15.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.932 177.6 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.562 ' HB3' ' O ' ' A' ' 30' ' ' PRO . 1.4 tt0 -62.27 -38.19 88.37 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 177.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.04 -31.0 68.41 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 175.153 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . 0.517 ' HE1' ' HA ' ' A' ' 66' ' ' ARG . 4.8 mtt -100.34 27.15 5.91 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.026 177.886 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.808 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 8.5 p-80 -66.32 -30.84 3.83 Favored Pre-proline 0 CA--C 1.536 0.439 0 N-CA-C 113.719 1.007 . . . . 0.0 113.719 -176.438 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.808 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 4.1 Cg_exo -39.19 -28.93 0.18 Allowed 'Trans proline' 0 C--N 1.361 1.203 0 C-N-CA 122.271 1.981 . . . . 0.0 112.098 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.845 HG21 HG13 ' A' ' 73' ' ' VAL . 32.9 m -78.43 -83.85 0.08 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.393 177.637 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.48 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.2 OUTLIER -171.09 48.21 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.369 179.277 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.435 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -37.41 -37.85 0.21 Allowed 'General case' 0 N--CA 1.469 0.477 0 O-C-N 123.307 0.379 . . . . 0.0 111.975 -179.406 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.64 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.2 -59.76 6.13 Favored Glycine 0 C--N 1.33 0.235 0 CA-C-N 116.139 -0.482 . . . . 0.0 113.815 -179.259 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.889 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -77.49 -30.99 53.35 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.106 0.409 . . . . 0.0 112.106 -177.587 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.74 HD12 HG21 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -54.09 -56.24 10.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.113 -179.249 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.793 ' HA ' HD22 ' A' ' 28' ' ' LEU . 9.1 t -47.89 -49.34 30.04 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.083 -179.381 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.572 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -49.56 -61.94 5.19 Favored Glycine 0 CA--C 1.521 0.423 0 C-N-CA 121.153 -0.546 . . . . 0.0 113.595 -179.375 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.599 ' SD ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.2 -62.87 1.38 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.815 0.307 . . . . 0.0 111.827 -177.79 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.701 ' HB2' HD21 ' A' ' 28' ' ' LEU . 1.6 mm? -70.17 1.74 4.43 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 -177.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.591 ' HA ' HD13 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -66.52 -8.76 28.78 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.942 -0.303 . . . . 0.0 111.161 179.924 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.491 ' HG3' ' O ' ' B' ' 9' ' ' ASN . 2.7 mm-40 -74.65 16.14 0.3 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.414 0.626 . . . . 0.0 109.531 176.755 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.751 HD11 ' NZ ' ' A' ' 68' ' ' LYS . 0.2 OUTLIER -82.41 162.94 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.558 -179.833 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.505 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 3.5 m-20 -70.7 160.8 31.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.9 0.381 . . . . 0.0 111.873 -178.728 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.865 ' HA ' HD23 ' A' ' 55' ' ' LEU . 4.4 m120 -89.12 -29.35 19.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.689 177.272 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -73.9 -30.72 62.76 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 176.768 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.505 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.1 OUTLIER -78.22 -28.87 48.04 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.675 178.981 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.865 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.9 OUTLIER -58.69 -44.84 90.41 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 179.428 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.639 ' HA ' HD11 ' A' ' 59' ' ' LEU . 8.0 tt -57.74 -49.18 77.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.37 177.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -57.06 -22.64 40.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.685 -179.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.689 ' HB3' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -71.27 -53.67 13.52 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -178.754 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.865 HD13 ' H ' ' A' ' 59' ' ' LEU . 0.0 OUTLIER -68.11 -7.39 29.25 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 119.997 -0.681 . . . . 0.0 110.691 179.891 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.472 ' HG3' ' O ' ' A' ' 56' ' ' LEU . 4.9 mt-10 -99.46 -11.38 21.15 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.926 176.237 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.546 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 3.4 m -122.32 85.56 47.43 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.184 -179.026 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -62.51 -33.4 78.77 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.186 1.924 . . . . 0.0 111.65 178.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -78.44 -47.02 18.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.485 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.499 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 1.9 m -71.37 -54.9 9.19 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.917 0.389 . . . . 0.0 111.58 -178.304 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 1.02 HD21 HD13 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -58.21 -62.16 2.03 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.707 -177.805 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.688 ' N ' HD13 ' A' ' 65' ' ' LEU . 1.5 ttm180 -50.47 -37.16 36.94 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.746 -0.381 . . . . 0.0 111.345 -177.374 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.61 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 1.4 t -69.47 -34.53 74.5 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.312 0.577 . . . . 0.0 110.172 178.144 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.751 ' NZ ' HD11 ' A' ' 50' ' ' ILE . 3.0 ttpp -65.91 -57.23 8.33 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.161 178.716 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.528 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 37.1 t -64.93 -18.89 24.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.25 178.457 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.61 ' HB3' ' O ' ' A' ' 67' ' ' SER . 25.6 t70 -54.29 -48.72 70.96 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 176.727 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.435 ' HB3' HD13 ' B' ' 6' ' ' LEU . 18.5 tt0 -66.08 -35.17 79.79 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.682 176.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.643 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -55.33 -40.74 71.57 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.35 178.044 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.845 HG13 HG21 ' A' ' 38' ' ' THR . 9.9 t -60.7 -34.21 57.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.026 177.516 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.38 -35.09 65.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.696 -179.543 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.518 HG22 ' O ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -57.35 -29.68 33.68 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-O 121.019 0.438 . . . . 0.0 109.899 179.53 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.889 HD11 ' HB3' ' A' ' 42' ' ' LYS . 3.7 mm? -71.93 -54.95 8.43 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.772 178.11 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -50.91 -33.81 25.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.252 179.65 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.54 -32.59 32.18 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.662 177.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 84.1 t60 . . . . . 0 C--N 1.331 -0.222 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.077 -179.834 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 2.8 m120 . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.809 0.338 . . . . 0.0 110.977 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.487 HD21 ' HG2' ' A' ' 68' ' ' LYS . 7.2 tp -69.58 -72.76 0.18 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.09 -179.769 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 7' ' ' ASN . . . . . 0.538 HD22 ' H ' ' B' ' 9' ' ' ASN . 1.8 t30 -88.95 130.24 45.39 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.985 179.668 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 3.4 Cg_exo -76.66 -0.76 10.82 Favored 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 122.476 2.117 . . . . 0.0 112.007 179.347 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 9' ' ' ASN . . . . . 0.538 ' H ' HD22 ' B' ' 7' ' ' ASN . 68.9 m-20 -123.23 48.06 1.89 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.005 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . 0.579 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.37 99.15 0.07 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.812 -179.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.473 ' O ' ' HA ' ' A' ' 46' ' ' MET . 0.0 OUTLIER -122.37 153.58 38.83 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.679 178.407 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . 0.576 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 5.7 tt0 -55.4 169.85 0.27 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.916 0.388 . . . . 0.0 111.511 -179.464 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 13' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.129 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.581 179.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.8 ' HB3' HE22 ' A' ' 20' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.877 0.37 . . . . 0.0 110.716 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.413 ' HE2' ' HB2' ' B' ' 11' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.984 -179.606 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.737 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 8.9 t . . . . . 0 CA--C 1.522 -0.126 0 CA-C-O 120.566 0.222 . . . . 0.0 110.89 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.41 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.09 -37.11 76.36 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 177.381 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.4 t -70.45 -34.01 71.96 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.884 177.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.737 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 11.8 mtm -64.29 -36.41 84.02 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 177.63 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.598 HD11 ' HB3' ' A' ' 24' ' ' LEU . 2.0 mp -52.12 -52.47 51.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.996 178.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.33 -28.7 68.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.233 178.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.2 p -101.4 17.73 21.92 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.953 -178.097 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.576 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.696 -0.229 . . . . 0.0 111.0 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.576 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.5 OUTLIER . . . . . 0 N--CA 1.455 -0.224 0 CA-C-O 120.654 0.264 . . . . 0.0 111.11 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.573 HE21 ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -46.52 -60.5 2.32 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.745 -177.812 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.618 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -56.05 -22.38 27.19 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.913 -177.617 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.618 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 5.9 tt0 -73.37 -78.76 0.09 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.013 0.435 . . . . 0.0 111.428 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . 0.628 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.3 -97.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.68 -176.396 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.628 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -59.62 -2.19 0.33 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -175.714 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.443 ' HA3' HD11 ' A' ' 48' ' ' LEU . . . 65.21 -115.55 7.85 Favored Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 108.672 -1.771 . . . . 0.0 108.672 -174.426 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.499 ' O ' HD13 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -75.8 -69.65 0.48 Allowed 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 169.386 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.919 ' HG2' HD22 ' A' ' 59' ' ' LEU . 4.8 tpt180 -159.48 13.01 0.14 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.377 -1.283 . . . . 0.0 108.156 175.48 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.543 HD12 HD11 ' A' ' 32' ' ' ILE . 4.2 mm? -57.41 -83.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.56 -1.2 . . . . 0.0 113.809 -173.187 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.673 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -33.04 -51.47 0.66 Allowed Pre-proline 0 CA--C 1.536 0.404 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 -174.846 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.593 ' HG2' ' O ' ' A' ' 27' ' ' ARG . 10.5 Cg_endo -56.39 -42.0 70.42 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.394 2.062 . . . . 0.0 113.646 -177.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.86 ' HB3' HD11 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.84 -48.26 54.91 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 120.128 -0.629 . . . . 0.0 109.893 -179.665 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.543 HD11 HD12 ' A' ' 28' ' ' LEU . 0.5 OUTLIER -71.33 -14.1 17.51 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.626 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.037 178.424 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.651 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 1.3 tp-100 -62.19 -39.29 92.23 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.196 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.77 -29.87 69.94 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.257 -0.883 . . . . 0.0 108.964 174.479 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . 0.534 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 7.7 mtt -101.99 26.14 7.91 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.349 178.184 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.651 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -64.33 -31.98 6.69 Favored Pre-proline 0 CA--C 1.535 0.392 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -177.897 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.592 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 51.0 Cg_exo -35.0 -34.36 0.1 OUTLIER 'Trans proline' 0 C--N 1.364 1.365 0 C-N-CA 122.16 1.907 . . . . 0.0 112.008 178.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.43 ' HB ' ' H ' ' A' ' 39' ' ' LEU . 20.5 m -78.19 -89.63 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 175.723 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.596 HD23 HD11 ' A' ' 76' ' ' LEU . 3.1 tp -171.93 67.63 0.04 OUTLIER 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.427 177.448 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.516 ' HB1' ' HB ' ' A' ' 32' ' ' ILE . . . -50.24 -24.5 2.92 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.804 0.335 . . . . 0.0 111.573 179.542 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.624 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -49.89 -62.98 4.53 Favored Glycine 0 CA--C 1.518 0.265 0 CA-C-N 115.965 -0.562 . . . . 0.0 114.298 -178.177 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.661 ' HB3' HD12 ' A' ' 76' ' ' LEU . 2.4 tptm -77.42 -32.79 54.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 117.169 0.484 . . . . 0.0 112.03 -177.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.653 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 18.7 mt -54.21 -55.95 12.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.729 -0.214 . . . . 0.0 111.427 -178.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.58 HG21 ' CD2' ' A' ' 29' ' ' PHE . 4.7 t -47.69 -46.86 29.82 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.887 0.375 . . . . 0.0 110.473 179.077 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.717 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -54.44 -61.95 6.7 Favored Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 115.73 -0.668 . . . . 0.0 113.551 -179.559 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.528 ' SD ' ' HG3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.73 -48.07 75.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.859 0.329 . . . . 0.0 111.414 -178.322 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.453 ' O ' ' HB ' ' A' ' 50' ' ' ILE . 3.2 mm? -80.1 2.43 24.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.439 -179.493 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.498 ' HG ' ' CD1' ' B' ' 13' ' ' PHE . 0.0 OUTLIER -65.93 -12.41 54.53 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.979 0.418 . . . . 0.0 110.392 179.333 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -78.95 17.85 0.69 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.277 177.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.453 ' HB ' ' O ' ' A' ' 47' ' ' LEU . 0.6 OUTLIER -83.58 162.74 3.07 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.876 -179.53 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.438 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 1.8 m-20 -70.76 158.84 35.6 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.769 -178.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.897 ' HA ' HD23 ' A' ' 55' ' ' LEU . 4.7 m120 -83.58 -28.28 28.65 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.788 177.178 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.645 ' HA ' HD21 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -74.51 -32.03 62.37 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.408 0.623 . . . . 0.0 109.902 177.419 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.438 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 1.0 OUTLIER -77.84 -26.61 49.53 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.483 178.92 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.897 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.5 OUTLIER -62.48 -49.66 74.53 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.654 179.984 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.692 ' HA ' HD21 ' A' ' 59' ' ' LEU . 0.4 OUTLIER -59.59 -40.98 89.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.985 -179.441 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 3.3 m-70 -63.06 -20.61 65.5 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.634 -179.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.533 ' HE2' ' HA ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -76.89 -60.0 2.54 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -178.77 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.919 HD22 ' HG2' ' A' ' 27' ' ' ARG . 2.5 pt? -66.69 -4.06 8.04 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.375 179.662 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.456 ' HB3' ' O ' ' A' ' 56' ' ' LEU . 1.3 tt0 -104.24 -19.12 14.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.894 177.663 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.446 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 0.5 OUTLIER -122.52 87.14 49.08 Favored Pre-proline 0 C--O 1.223 -0.334 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.134 179.398 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -54.3 -34.11 78.74 Favored 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.469 2.113 . . . . 0.0 112.661 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.634 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.0 -48.7 15.59 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.617 -178.998 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.634 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 23.3 m -72.73 -26.68 61.67 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.176 0.512 . . . . 0.0 111.098 -179.193 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.86 HD11 ' HB3' ' A' ' 31' ' ' LEU . 0.2 OUTLIER -77.8 -65.79 0.92 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.155 -178.6 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.461 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.3 OUTLIER -49.75 -28.39 6.11 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.807 -177.854 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.462 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.5 OUTLIER -68.64 -39.56 80.68 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.25 178.348 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.491 ' HE2' ' HE2' ' A' ' 58' ' ' MET . 0.2 OUTLIER -65.03 -59.91 3.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.211 178.918 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.514 ' CG1' HG23 ' A' ' 32' ' ' ILE . 54.4 t -63.15 -20.51 26.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.007 -179.426 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.622 ' O ' HG22 ' A' ' 73' ' ' VAL . 23.8 t70 -55.07 -49.72 70.94 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 176.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.586 ' HG2' ' HB3' ' B' ' 5' ' ' ASN . 49.1 tt0 -68.97 -26.67 65.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.801 176.834 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.653 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -62.63 -51.84 65.69 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.367 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.622 HG22 ' O ' ' A' ' 70' ' ' ASP . 5.3 m -56.73 -28.43 27.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.161 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 177.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.538 ' O ' ' HG3' ' A' ' 77' ' ' GLN . . . -72.59 -30.62 64.53 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.342 179.33 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.801 HG12 ' HB2' ' B' ' 5' ' ' ASN . 1.0 OUTLIER -67.44 -37.41 78.86 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.189 0 CA-C-O 120.791 0.329 . . . . 0.0 110.532 179.617 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.661 HD12 ' HB3' ' A' ' 42' ' ' LYS . 0.3 OUTLIER -71.87 -52.7 16.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.945 179.548 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.538 ' HG3' ' O ' ' A' ' 74' ' ' ALA . 1.5 pp0? -56.05 -35.18 66.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.121 0.486 . . . . 0.0 109.997 179.556 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.91 -21.09 40.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.613 178.004 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 11.3 t-160 . . . . . 0 C--N 1.331 -0.207 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.718 179.452 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 5' ' ' ASN . . . . . 0.801 ' HB2' HG12 ' A' ' 75' ' ' VAL . 2.0 m-20 . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.793 0.33 . . . . 0.0 110.929 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' B' ' 6' ' ' LEU . 1.9 mt -67.52 -82.85 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.795 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 7' ' ' ASN . . . . . 0.404 HD22 ' H ' ' B' ' 9' ' ' ASN . 1.6 t30 -74.66 124.18 89.53 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.917 179.758 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.26 1.98 7.73 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.18 1.92 . . . . 0.0 111.791 178.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 9' ' ' ASN . . . . . 0.69 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 22.8 m120 -123.23 48.54 1.81 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.7 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.33 98.5 0.06 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.708 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.69 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 19.9 mmtp -122.88 153.09 40.1 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.323 178.204 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -55.26 165.0 0.81 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.863 0.363 . . . . 0.0 111.12 -179.682 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 13' ' ' PHE . . . . . 0.717 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.2 t80 . . . . . 0 C--N 1.331 -0.231 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.741 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.456 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.46 0.074 0 CA-C-O 120.693 0.282 . . . . 0.0 110.862 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.331 -0.223 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.013 -179.957 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.756 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 6.9 t . . . . . 0 CA--C 1.523 -0.086 0 CA-C-O 120.537 0.208 . . . . 0.0 110.647 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.448 ' HB2' ' OE1' ' A' ' 33' ' ' GLN . . . -59.41 -35.63 74.34 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 177.341 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 5.5 t -71.23 -34.69 71.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.737 177.365 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.756 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.0 mtm -64.23 -36.25 83.48 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.85 177.692 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.713 HD11 ' HB3' ' A' ' 24' ' ' LEU . 1.9 mp -52.41 -53.53 43.91 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.895 178.768 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.42 -26.74 67.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.976 178.268 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.4 22.84 11.92 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.778 -178.654 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.76 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 CA--C 1.533 0.312 0 CA-C-O 120.611 0.243 . . . . 0.0 111.065 179.81 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.76 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.9 OUTLIER . . . . . 0 N--CA 1.453 -0.28 0 CA-C-O 120.837 0.351 . . . . 0.0 110.608 . . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.414 ' NE2' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -53.11 -63.25 1.21 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.637 -179.565 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.466 ' H ' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -56.17 -21.35 22.35 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.2 -179.087 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.467 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 2.1 tp-100 -73.55 -81.04 0.07 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.973 0.416 . . . . 0.0 111.667 179.571 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . 0.574 ' SD ' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.67 -97.11 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -176.272 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.713 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -56.93 0.71 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -175.183 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.604 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 65.12 -117.51 10.44 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 108.481 -1.848 . . . . 0.0 108.481 -174.783 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.432 ' HG3' ' HA ' ' A' ' 52' ' ' ASN . 0.3 OUTLIER -75.54 -68.03 0.61 Allowed 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 168.715 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.757 ' HB2' HD13 ' A' ' 55' ' ' LEU . 1.0 OUTLIER -160.51 7.69 0.09 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.121 -1.4 . . . . 0.0 107.914 174.784 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.98 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.73 -73.21 0.09 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.387 -1.279 . . . . 0.0 114.139 -173.064 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.649 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -36.46 -49.23 1.81 Allowed Pre-proline 0 CA--C 1.536 0.426 0 N-CA-C 113.612 0.968 . . . . 0.0 113.612 -175.789 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.6 ' HG3' ' HB2' ' A' ' 24' ' ' LEU . 18.9 Cg_endo -61.76 -39.33 53.56 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 122.19 1.926 . . . . 0.0 113.593 -177.41 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.727 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.15 -46.95 60.49 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 120.26 -0.576 . . . . 0.0 110.087 -179.496 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.596 HD11 HD23 ' A' ' 28' ' ' LEU . 0.7 OUTLIER -72.31 -17.71 18.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.294 -0.412 . . . . 0.0 109.925 177.71 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.636 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 1.0 OUTLIER -63.36 -31.98 73.28 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 176.286 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.25 -27.77 61.76 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 175.011 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . 0.451 ' HE1' ' HB ' ' A' ' 69' ' ' VAL . 12.2 mtt -99.97 16.82 22.67 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 114.862 -1.063 . . . . 0.0 109.655 177.17 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.81 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 0.4 OUTLIER -63.45 -34.81 13.95 Favored Pre-proline 0 CA--C 1.534 0.345 0 CA-C-N 115.379 -0.828 . . . . 0.0 112.011 -179.235 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.81 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 2.2 Cg_endo -39.87 -30.05 0.35 Allowed 'Trans proline' 0 C--N 1.364 1.369 0 C-N-CA 122.106 1.871 . . . . 0.0 110.713 177.386 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.639 HG21 ' CG1' ' A' ' 73' ' ' VAL . 0.2 OUTLIER -78.18 -84.38 0.08 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.209 175.161 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.716 HD23 HD11 ' A' ' 76' ' ' LEU . 11.7 tp -172.15 63.41 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 177.603 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.34 -176.02 0.06 Allowed 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 175.736 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.649 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . 103.91 -69.21 0.28 Allowed Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.292 -0.956 . . . . 0.0 113.112 179.664 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.693 ' HE2' ' HG2' ' A' ' 46' ' ' MET . 1.0 OUTLIER -77.25 -34.97 55.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.825 0.345 . . . . 0.0 111.04 -179.655 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.698 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 17.6 mt -54.08 -53.03 31.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.108 -179.39 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.98 ' HA ' HD22 ' A' ' 28' ' ' LEU . 8.9 t -54.65 -43.75 72.63 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-O 120.9 0.381 . . . . 0.0 110.313 178.22 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.788 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -48.11 -61.27 5.02 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.573 -0.74 . . . . 0.0 113.457 -178.769 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.792 ' CE ' HG21 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -61.8 -50.08 73.78 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -177.757 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.751 HD13 ' HB2' ' B' ' 7' ' ' ASN . 4.0 mm? -78.75 11.05 2.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.602 0.239 . . . . 0.0 111.493 -179.018 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.632 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -63.79 -29.44 70.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.295 -179.186 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.32 29.02 0.15 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.772 0.32 . . . . 0.0 110.921 179.094 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.549 HD11 ' HZ2' ' A' ' 68' ' ' LYS . 2.5 tt -82.77 169.78 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.365 179.081 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.567 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 16.8 m-20 -67.54 137.59 55.86 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.537 -179.0 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.838 ' HA ' HD23 ' A' ' 55' ' ' LEU . 4.9 m120 -76.51 -27.71 56.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.171 0.51 . . . . 0.0 109.642 177.198 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 42.6 m -74.05 -31.27 62.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.639 177.437 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.567 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 2.2 mm-40 -77.51 -29.89 52.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.668 178.925 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.838 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -58.85 -46.73 87.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.284 -179.953 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.461 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 33.1 tp -61.64 -43.6 98.55 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.409 178.843 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 28.8 m80 -66.93 -19.41 65.72 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.982 179.79 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.514 ' SD ' ' HA ' ' A' ' 65' ' ' LEU . 17.9 mmt -72.4 -47.51 48.65 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.988 -179.983 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.595 HD23 ' CG ' ' A' ' 27' ' ' ARG . 0.2 OUTLIER -66.33 -20.91 66.22 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.229 -179.831 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -96.54 -7.54 34.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.716 0.293 . . . . 0.0 111.576 -179.316 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.627 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -122.88 88.39 50.51 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.891 -179.951 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -62.63 -32.1 79.24 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.302 2.001 . . . . 0.0 112.052 179.552 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.401 ' O ' ' HB2' ' A' ' 67' ' ' SER . 7.6 mt-10 -78.06 -48.84 15.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.498 -179.776 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 26.1 m -69.49 -48.8 59.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.394 -178.376 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.627 ' HB3' ' O ' ' A' ' 61' ' ' SER . 0.9 OUTLIER -59.75 -64.83 0.81 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.874 -178.662 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.615 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.5 OUTLIER -50.1 -29.38 8.88 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.068 -177.215 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.401 ' HB2' ' O ' ' A' ' 63' ' ' GLU . 0.6 OUTLIER -63.75 -43.96 94.91 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.078 0.466 . . . . 0.0 110.229 178.134 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.722 ' HG2' HD11 ' B' ' 6' ' ' LEU . 25.6 mtpt -66.16 -60.68 2.57 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.937 179.327 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.505 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 75.6 t -61.13 -23.18 29.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.194 -178.542 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.45 ' HB2' ' O ' ' A' ' 66' ' ' ARG . 24.8 t70 -55.58 -49.95 71.37 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 176.612 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.665 ' HG2' ' HB3' ' B' ' 5' ' ' ASN . 0.5 OUTLIER -68.9 -28.16 66.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.69 176.542 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.698 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -59.83 -37.66 79.84 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.068 177.933 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.639 ' CG1' HG21 ' A' ' 38' ' ' THR . 28.4 t -66.43 -29.63 47.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 176.975 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.413 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -71.11 -40.39 71.51 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.292 179.46 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.792 HG21 ' CE ' ' A' ' 46' ' ' MET . 0.9 OUTLIER -54.55 -39.33 45.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-O 120.96 0.41 . . . . 0.0 110.222 179.385 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.716 HD11 HD23 ' A' ' 39' ' ' LEU . 1.2 tt -64.28 -46.45 83.64 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.747 -178.751 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 8.7 mm100 -53.86 -35.85 61.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.263 179.428 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.25 -26.91 35.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.469 177.904 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 4.2 t60 . . . . . 0 C--N 1.332 -0.196 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.847 179.724 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' B' B ' 5' ' ' ASN . . . . . 0.67 ' HB2' HG12 ' A' ' 75' ' ' VAL . 39.2 m-20 . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.766 0.317 . . . . 0.0 110.874 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.748 ' HB3' HD11 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -74.15 -87.87 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.408 179.349 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' B' B ' 7' ' ' ASN . . . . . 0.799 HD22 ' H ' ' B' ' 9' ' ' ASN . 0.2 OUTLIER -74.41 131.5 80.23 Favored Pre-proline 0 C--N 1.332 -0.176 0 CA-C-N 116.616 -0.265 . . . . 0.0 110.546 178.714 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.516 ' HD2' ' ND2' ' B' ' 7' ' ' ASN . 71.9 Cg_endo -75.24 -3.91 14.59 Favored 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.109 1.872 . . . . 0.0 112.096 179.262 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 9' ' ' ASN . . . . . 0.799 ' H ' HD22 ' B' ' 7' ' ' ASN . 71.8 m-80 -123.35 49.8 1.65 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.657 179.543 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . 0.704 ' HB1' ' HB2' ' A' ' 46' ' ' MET . . . -54.17 95.0 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.714 -179.283 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.645 ' C ' ' HA ' ' A' ' 46' ' ' MET . 6.0 mttp -109.57 124.26 50.82 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.704 179.288 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . 0.674 ' HG2' ' HE3' ' A' ' 42' ' ' LYS . 51.6 mt-10 -47.48 173.01 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -177.895 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 13' ' ' PHE . . . . . 0.788 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.4 OUTLIER . . . . . 0 N--CA 1.463 0.192 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.352 -179.929 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.907 0.384 . . . . 0.0 110.735 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 1.7 t80 . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.055 -179.35 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.835 HG21 ' HB3' ' A' ' 29' ' ' PHE . 1.8 t . . . . . 0 N--CA 1.455 -0.187 0 CA-C-O 120.601 0.239 . . . . 0.0 110.469 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.408 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.26 -37.06 76.67 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 177.237 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.4 t -69.08 -35.54 76.61 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.659 177.014 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.722 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.2 mtm -64.17 -36.47 84.16 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.886 177.669 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.755 HD11 ' HB3' ' A' ' 24' ' ' LEU . 2.4 mp -52.27 -48.94 65.0 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.156 179.356 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.02 -31.09 71.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.129 178.903 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 56.8 m -101.44 15.47 28.73 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.757 -178.882 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.591 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.031 179.967 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.691 ' HG3' ' HB3' ' A' ' 22' ' ' GLN . 4.6 tp10 . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.691 0.281 . . . . 0.0 111.081 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.436 ' O ' HD23 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -52.83 -60.08 3.7 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.345 -179.868 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.526 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.86 -20.54 15.91 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.496 -178.171 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.691 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -73.2 -79.98 0.07 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.908 0.385 . . . . 0.0 111.425 179.317 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . 0.671 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.55 -94.39 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.687 -176.979 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.755 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -62.11 -1.56 0.73 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -175.291 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.55 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.87 -116.71 9.27 Favored Glycine 0 N--CA 1.444 -0.794 0 N-CA-C 108.427 -1.869 . . . . 0.0 108.427 -174.268 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.424 ' O ' HD13 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -76.63 -69.63 0.5 Allowed 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 169.43 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.914 ' HG2' HD22 ' A' ' 59' ' ' LEU . 1.3 tpt180 -159.86 12.46 0.13 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.318 -1.31 . . . . 0.0 107.985 176.09 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.565 HD12 HD11 ' A' ' 32' ' ' ILE . 3.6 mm? -57.54 -76.06 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.488 -1.233 . . . . 0.0 113.606 -173.243 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.835 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -41.0 -46.65 6.97 Favored Pre-proline 0 C--N 1.325 -0.495 0 N-CA-C 113.728 1.01 . . . . 0.0 113.728 -174.653 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.602 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 50.4 Cg_exo -57.53 -43.83 47.55 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.236 1.957 . . . . 0.0 113.818 -178.216 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.851 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.7 -48.83 52.62 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.228 -178.066 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.84 HG21 HD12 ' A' ' 43' ' ' ILE . 0.9 OUTLIER -73.43 -14.52 16.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.522 179.15 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.626 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.7 OUTLIER -60.88 -42.33 97.76 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 177.03 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.65 -30.02 70.66 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.143 174.902 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . 0.507 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 6.3 mtt -101.41 26.79 6.84 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.657 178.576 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.626 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.4 p-80 -66.04 -32.37 5.61 Favored Pre-proline 0 CA--C 1.537 0.46 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -177.457 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.615 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 44.0 Cg_exo -34.11 -35.9 0.09 OUTLIER 'Trans proline' 0 C--N 1.363 1.318 0 C-N-CA 122.383 2.055 . . . . 0.0 112.466 179.457 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.448 ' HB ' ' H ' ' A' ' 39' ' ' LEU . 1.8 m -78.76 -84.13 0.08 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.816 176.891 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.812 ' HB3' HD22 ' A' ' 76' ' ' LEU . 0.6 OUTLIER -171.36 63.54 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.396 178.212 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.563 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -50.09 -38.29 37.86 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.888 0.375 . . . . 0.0 111.398 179.516 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.582 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -47.94 -47.94 25.24 Favored Glycine 0 CA--C 1.517 0.197 0 CA-C-N 115.782 -0.645 . . . . 0.0 114.13 -178.227 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.616 ' HE3' ' HG3' ' B' ' 12' ' ' GLU . 2.2 tptm -77.74 -42.59 33.66 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -177.192 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.921 HG21 ' HB1' ' A' ' 72' ' ' ALA . 20.3 mt -53.51 -56.51 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 C-N-CA 120.761 -0.376 . . . . 0.0 111.288 -178.267 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.573 HG21 ' CD2' ' A' ' 29' ' ' PHE . 9.8 t -47.04 -46.92 22.49 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 179.234 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.921 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -51.57 -67.51 1.96 Allowed Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 115.33 -0.85 . . . . 0.0 113.212 179.352 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.618 ' HA ' ' C ' ' B' ' 11' ' ' LYS . 0.0 OUTLIER -55.57 -57.75 10.65 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -177.246 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.814 HD23 ' HB2' ' B' ' 7' ' ' ASN . 3.5 mp -79.39 14.52 1.54 Allowed 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -177.068 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.513 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.71 -10.51 47.48 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.235 0.54 . . . . 0.0 109.543 176.359 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.496 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 3.5 mt-10 -80.17 19.89 0.7 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.711 178.96 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.462 HG12 ' HG2' ' A' ' 54' ' ' GLU . 1.3 tt -83.31 162.64 3.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.021 -179.236 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.46 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 4.0 m-20 -70.66 156.78 39.03 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.946 0.403 . . . . 0.0 111.72 -178.449 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.943 ' HA ' HD23 ' A' ' 55' ' ' LEU . 6.5 m120 -84.09 -30.11 26.26 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.21 178.312 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 8.4 t -73.9 -34.03 64.25 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.369 0.604 . . . . 0.0 109.53 177.342 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.462 ' HG2' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -75.84 -28.54 58.28 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.52 179.147 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.943 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -59.59 -46.54 88.63 Favored 'General case' 0 CA--C 1.522 -0.128 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.298 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.646 ' HA ' HD21 ' A' ' 59' ' ' LEU . 61.7 tp -57.83 -49.39 76.83 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.072 -179.678 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.469 ' O ' ' HB2' ' A' ' 61' ' ' SER . 19.3 m-70 -58.78 -21.61 56.33 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.806 -178.992 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.606 ' HE2' ' HA ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -76.17 -57.99 3.54 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -177.742 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.914 HD22 ' HG2' ' A' ' 27' ' ' ARG . 2.2 pt? -65.73 -6.86 12.88 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.538 -0.465 . . . . 0.0 111.098 -178.864 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -105.98 -9.43 17.07 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.94 0.4 . . . . 0.0 110.634 177.745 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.587 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -122.66 97.93 43.82 Favored Pre-proline 0 C--N 1.331 -0.199 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.099 179.61 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -64.94 -30.07 57.55 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.188 1.925 . . . . 0.0 111.924 179.114 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.451 ' O ' ' HB2' ' A' ' 67' ' ' SER . 3.2 mm-40 -78.31 -51.77 9.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.615 -179.75 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.416 ' HB3' ' HB3' ' A' ' 61' ' ' SER . 47.3 t -69.23 -40.29 78.01 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.887 -177.819 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.851 HD21 HD13 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -77.95 -65.14 1.01 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.177 -176.179 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.686 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -51.06 -33.7 26.83 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.885 -0.326 . . . . 0.0 111.524 -176.797 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.471 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 2.9 m -69.97 -35.84 74.75 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.001 0.429 . . . . 0.0 110.195 178.286 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.33 -52.34 48.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.304 178.717 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.615 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 55.4 t -70.37 -16.37 19.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.484 179.127 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.608 ' O ' HG22 ' A' ' 73' ' ' VAL . 20.1 t0 -58.56 -49.05 78.84 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 176.554 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.54 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 2.4 tp10 -68.7 -21.86 64.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.59 176.258 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.921 ' HB1' HG21 ' A' ' 43' ' ' ILE . . . -64.18 -45.38 88.66 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.633 179.353 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.608 HG22 ' O ' ' A' ' 70' ' ' ASP . 2.2 m -59.66 -29.77 43.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 176.852 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.54 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -67.76 -25.18 65.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.91 178.398 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.752 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.3 m -69.89 -32.72 52.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 178.723 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.812 HD22 ' HB3' ' A' ' 39' ' ' LEU . 8.0 mt -70.98 -57.67 4.32 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.956 179.09 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.529 ' HG3' ' O ' ' A' ' 74' ' ' ALA . 0.0 OUTLIER -51.27 -35.58 38.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.047 179.976 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.16 -26.49 36.01 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.791 177.775 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 23.4 t-80 . . . . . 0 C--N 1.333 -0.118 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.847 179.94 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 5.5 m120 . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.798 0.332 . . . . 0.0 110.943 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.42 HD13 ' HA ' ' B' ' 6' ' ' LEU . 0.0 OUTLIER -66.23 -79.16 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.943 179.829 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' B' B ' 7' ' ' ASN . . . . . 0.814 ' HB2' HD23 ' A' ' 47' ' ' LEU . 2.2 t30 -84.16 127.05 68.21 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.051 -179.841 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -78.65 5.03 5.88 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.236 1.957 . . . . 0.0 111.899 178.593 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -123.54 43.02 3.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.917 179.945 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . 0.555 ' HB1' ' HB2' ' A' ' 46' ' ' MET . . . -59.78 85.26 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.702 -179.768 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.618 ' C ' ' HA ' ' A' ' 46' ' ' MET . 0.4 OUTLIER -117.61 128.13 54.63 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.051 178.537 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . 0.616 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 6.2 tt0 -46.56 167.47 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -175.846 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 13' ' ' PHE . . . . . 0.921 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.4 OUTLIER . . . . . 0 N--CA 1.463 0.208 0 CA-C-N 115.206 -0.906 . . . . 0.0 109.91 179.605 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.956 0.408 . . . . 0.0 110.724 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.467 ' HD2' ' HB3' ' A' ' 48' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.974 -179.351 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.785 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 8.9 t . . . . . 0 N--CA 1.455 -0.222 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.46 -39.47 83.76 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 176.41 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 7.3 t -67.97 -34.62 76.89 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.734 177.111 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.785 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 9.2 mtm -64.43 -39.18 93.35 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.224 178.07 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.833 HD21 ' HB3' ' A' ' 24' ' ' LEU . 38.5 mt -52.27 -45.91 65.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.406 -179.9 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.15 -33.66 76.28 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.02 178.439 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.9 m -101.52 19.95 16.97 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.559 -179.098 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.454 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.331 -0.237 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.096 -179.97 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.469 ' O ' ' HB3' ' A' ' 22' ' ' GLN . 0.3 OUTLIER . . . . . 0 CA--C 1.526 0.046 0 CA-C-O 120.759 0.314 . . . . 0.0 111.158 . . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.499 HE21 ' HB2' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -46.74 -68.77 0.16 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.351 179.853 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.545 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.54 -20.23 12.5 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.775 -177.195 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.545 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 14.9 tt0 -73.35 -80.05 0.07 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.963 0.411 . . . . 0.0 111.533 179.153 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . 0.624 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.85 -94.14 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 -176.775 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.833 ' HB3' HD21 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -61.63 1.6 0.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -174.98 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.642 ' CA ' HD21 ' A' ' 48' ' ' LEU . . . 65.1 -117.52 10.47 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 108.598 -1.801 . . . . 0.0 108.598 -174.856 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.492 ' HG2' HG22 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -75.42 -67.25 0.68 Allowed 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 168.985 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.947 ' HG3' HD21 ' A' ' 31' ' ' LEU . 8.7 tpt180 -160.3 6.04 0.08 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.188 -1.369 . . . . 0.0 107.862 174.859 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.825 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.4 OUTLIER -60.01 -75.29 0.06 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.235 -1.348 . . . . 0.0 114.582 -172.175 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.496 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.2 OUTLIER -32.86 -50.81 0.63 Allowed Pre-proline 0 N--CA 1.468 0.468 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -175.484 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.615 ' HG2' ' O ' ' A' ' 27' ' ' ARG . 16.9 Cg_endo -60.25 -40.27 60.72 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 122.132 1.888 . . . . 0.0 113.167 -178.413 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.947 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.16 -48.42 51.97 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.136 179.844 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.726 HD11 HD23 ' A' ' 28' ' ' LEU . 0.9 OUTLIER -68.47 -20.61 25.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.229 -0.442 . . . . 0.0 109.892 178.045 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.658 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -63.44 -32.31 73.72 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 176.839 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.71 -26.04 63.22 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 174.903 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . 0.465 ' HE1' ' HB ' ' A' ' 69' ' ' VAL . 10.2 mtt -102.03 14.07 32.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.559 -1.2 . . . . 0.0 109.749 177.471 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.788 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 0.0 OUTLIER -62.51 -36.39 26.91 Favored Pre-proline 0 CA--C 1.533 0.293 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.946 -179.388 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.788 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 1.3 Cg_endo -42.5 -26.98 0.67 Allowed 'Trans proline' 0 C--N 1.362 1.246 0 C-N-CA 121.969 1.779 . . . . 0.0 110.691 177.435 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.522 HG21 HG11 ' A' ' 73' ' ' VAL . 0.9 OUTLIER -81.93 -82.12 0.14 Allowed 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.37 175.376 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.439 ' H ' ' HB ' ' A' ' 38' ' ' THR . 0.2 OUTLIER -172.19 65.69 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 178.347 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.477 ' HA ' HD12 ' A' ' 43' ' ' ILE . . . -64.15 -172.52 0.07 Allowed 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 176.098 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.807 ' O ' HG22 ' A' ' 44' ' ' THR . . . 108.38 -106.75 2.38 Favored Glycine 0 C--O 1.227 -0.335 0 C-N-CA 120.172 -1.014 . . . . 0.0 113.056 179.476 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.469 ' HA ' ' HD3' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -56.8 -22.51 36.72 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.659 0.266 . . . . 0.0 111.622 -178.077 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.654 HG12 ' HB2' ' A' ' 76' ' ' LEU . 40.7 mt -54.09 -46.2 66.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.76 0.314 . . . . 0.0 110.934 179.684 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.825 ' HA ' HD22 ' A' ' 28' ' ' LEU . 15.4 t -57.14 -44.81 83.74 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.264 -179.606 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -49.36 -43.53 34.79 Favored Glycine 0 CA--C 1.519 0.288 0 C-N-CA 121.2 -0.524 . . . . 0.0 113.766 -178.305 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.514 ' H ' ' HG2' ' A' ' 46' ' ' MET . 0.0 OUTLIER -76.1 -51.9 11.27 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -177.54 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.766 ' HB2' HD21 ' A' ' 28' ' ' LEU . 2.8 mm? -79.67 -0.05 32.35 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.985 -178.693 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.642 HD21 ' CA ' ' A' ' 25' ' ' GLY . 0.2 OUTLIER -66.19 -15.68 63.35 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 121.381 0.61 . . . . 0.0 109.938 177.66 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.549 ' HG2' ' HZ2' ' B' ' 11' ' ' LYS . 0.6 OUTLIER -74.6 17.08 0.22 Allowed 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.572 179.233 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.625 HD11 ' HE3' ' A' ' 68' ' ' LYS . 1.2 tt -84.59 170.35 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.75 179.368 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.624 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 6.9 m-20 -71.56 147.18 47.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.913 0.387 . . . . 0.0 111.721 179.993 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.776 ' HA ' HD23 ' A' ' 55' ' ' LEU . 2.1 t-20 -78.56 -30.84 47.04 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 176.771 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.568 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 0.6 OUTLIER -74.14 -30.46 62.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.395 0.617 . . . . 0.0 109.825 177.234 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.624 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -79.22 -22.67 44.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.364 179.068 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.883 HD13 ' HB2' ' A' ' 27' ' ' ARG . 0.6 OUTLIER -63.53 -47.82 80.07 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.392 179.258 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.661 ' HA ' HD11 ' A' ' 59' ' ' LEU . 2.3 pp -61.29 -41.45 96.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.907 0.384 . . . . 0.0 110.266 179.455 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.0 -13.09 56.96 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.947 178.78 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.583 ' HB2' ' O ' ' A' ' 55' ' ' LEU . 22.4 mmt -76.45 -57.38 3.9 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.473 -179.494 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.881 HD13 ' H ' ' A' ' 59' ' ' LEU . 0.0 OUTLIER -64.3 -10.79 26.33 Favored 'General case' 0 N--CA 1.463 0.176 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.206 179.286 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.54 ' N ' HD22 ' A' ' 59' ' ' LEU . 2.6 tp10 -92.44 -19.12 22.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.276 178.186 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.634 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 1.3 t -122.78 88.48 50.22 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.917 179.369 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -62.5 -31.27 80.42 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.281 1.987 . . . . 0.0 112.202 179.803 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -77.8 -48.44 16.56 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.424 -179.653 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.44 ' O ' ' HB2' ' A' ' 67' ' ' SER . 16.9 m -68.95 -47.73 64.94 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.027 0.442 . . . . 0.0 111.093 -178.935 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.703 ' CD1' HD13 ' A' ' 31' ' ' LEU . 0.6 OUTLIER -57.93 -64.17 1.0 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.749 -0.66 . . . . 0.0 112.01 -178.575 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.625 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.9 OUTLIER -49.03 -32.24 9.03 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.233 -177.084 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.501 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 5.1 m -58.71 -45.27 89.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.163 0.506 . . . . 0.0 110.196 178.233 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.625 ' HE3' HD11 ' A' ' 50' ' ' ILE . 12.3 mtmm -65.48 -64.47 0.85 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.716 179.472 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.517 HG11 HG12 ' A' ' 32' ' ' ILE . 82.8 t -57.52 -20.16 13.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.358 -178.8 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.501 ' HB3' ' O ' ' A' ' 67' ' ' SER . 5.9 t70 -55.92 -51.3 68.11 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 176.468 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.442 ' O ' HG13 ' A' ' 75' ' ' VAL . 1.0 OUTLIER -68.95 -29.17 67.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.827 177.049 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.651 ' O ' HG22 ' A' ' 75' ' ' VAL . . . -58.61 -40.98 84.81 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.32 178.543 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.621 ' HA ' HD13 ' A' ' 43' ' ' ILE . 24.8 t -62.24 -32.22 54.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 177.061 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.408 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -70.52 -38.63 74.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.289 179.394 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.651 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.9 -27.96 36.86 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 CA-C-O 120.995 0.426 . . . . 0.0 110.337 179.556 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.654 ' HB2' HG12 ' A' ' 43' ' ' ILE . 2.8 tm? -71.07 -48.76 50.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.317 178.865 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -60.1 -33.24 71.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.711 179.914 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.89 -20.08 42.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.871 179.138 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 . . . . . 0 C--N 1.331 -0.236 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.879 -179.93 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.167 0 CA-C-O 120.833 0.349 . . . . 0.0 110.923 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.586 HD11 ' O ' ' A' ' 68' ' ' LYS . 35.7 mt -75.98 -79.28 0.1 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.933 -179.97 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 7' ' ' ASN . . . . . 0.72 HD22 ' H ' ' B' ' 9' ' ' ASN . 0.5 OUTLIER -79.49 127.76 77.33 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.273 -179.36 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.511 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 5.9 Cg_exo -79.76 0.43 10.03 Favored 'Trans proline' 0 N--CA 1.459 -0.508 0 C-N-CA 122.744 2.296 . . . . 0.0 112.072 179.502 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 9' ' ' ASN . . . . . 0.72 ' H ' HD22 ' B' ' 7' ' ' ASN . 44.0 m-20 -123.51 48.82 1.79 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.877 179.845 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . 0.51 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.89 99.13 0.08 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.081 -0.508 . . . . 0.0 112.068 -179.697 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.549 ' HZ2' ' HG2' ' A' ' 49' ' ' GLU . 0.1 OUTLIER -128.0 -178.37 4.49 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 120.776 0.322 . . . . 0.0 110.987 177.432 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -68.61 176.98 2.65 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 121.001 0.429 . . . . 0.0 111.459 -179.55 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 13' ' ' PHE . . . . . 0.421 ' CD1' HD13 ' A' ' 48' ' ' LEU . 1.0 OUTLIER . . . . . 0 C--N 1.333 -0.134 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.13 178.053 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.494 ' HG3' HE22 ' A' ' 20' ' ' GLN . 3.9 mtpp . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.571 0.224 . . . . 0.0 110.464 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.426 ' OH ' ' HG3' ' B' ' 11' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.328 0 CA-C-O 120.831 0.348 . . . . 0.0 110.738 -179.837 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.801 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 13.1 t . . . . . 0 N--CA 1.455 -0.197 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.434 ' HB2' ' OE1' ' A' ' 33' ' ' GLN . . . -59.45 -35.66 74.48 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 176.869 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 26.8 t -72.96 -34.83 66.74 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.849 177.572 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.801 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 4.8 mtm -64.33 -38.72 92.04 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.013 178.189 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.815 HD21 ' HB3' ' A' ' 24' ' ' LEU . 37.3 mt -52.61 -51.29 60.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.099 179.37 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.25 -28.14 68.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.827 177.953 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.66 20.46 16.15 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.77 -178.702 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.697 ' HB1' ' CB ' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.329 -0.307 0 CA-C-O 120.612 0.244 . . . . 0.0 111.12 -179.924 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.697 ' CB ' ' HB1' ' A' ' 15' ' ' ALA . 0.4 OUTLIER . . . . . 0 N--CA 1.453 -0.313 0 CA-C-O 120.603 0.24 . . . . 0.0 110.871 . . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -46.05 -65.73 0.51 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.375 -178.651 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.76 -24.88 37.92 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.265 -178.79 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.426 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 6.6 tp60 -73.62 -77.36 0.11 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.736 0.303 . . . . 0.0 111.648 179.164 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . 0.728 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -67.24 -97.06 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 112.543 0.571 . . . . 0.0 112.543 -176.375 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.898 HD12 ' HD3' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -62.09 1.07 0.33 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 113.604 0.965 . . . . 0.0 113.604 -175.525 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.695 ' HA3' HD21 ' A' ' 48' ' ' LEU . . . 64.71 -118.47 12.55 Favored Glycine 0 N--CA 1.445 -0.757 0 N-CA-C 108.435 -1.866 . . . . 0.0 108.435 -174.865 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 51' ' ' ASP . 1.8 mp0 -75.78 -68.45 0.57 Allowed 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 168.831 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.898 ' HD3' HD12 ' A' ' 24' ' ' LEU . 8.4 tpt85 -160.24 13.26 0.12 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 113.986 -1.461 . . . . 0.0 107.814 174.59 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.807 HD12 ' HA ' ' A' ' 44' ' ' THR . 1.4 mm? -56.98 -80.23 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 114.568 -1.196 . . . . 0.0 113.627 -173.125 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.8 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -36.14 -49.78 1.67 Allowed Pre-proline 0 CA--C 1.537 0.447 0 N-CA-C 113.626 0.972 . . . . 0.0 113.626 -174.501 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.75 ' HB2' ' NH1' ' A' ' 27' ' ' ARG . 50.6 Cg_exo -58.03 -40.92 73.4 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.209 1.939 . . . . 0.0 113.938 -177.852 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.815 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.86 -47.24 60.37 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 120.343 -0.543 . . . . 0.0 109.906 -179.195 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.546 ' O ' ' HB2' ' A' ' 40' ' ' ALA . 0.3 OUTLIER -74.14 -13.52 15.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.049 178.5 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.634 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 1.5 tt0 -61.46 -42.01 98.1 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 108.55 -0.908 . . . . 0.0 108.55 177.357 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.93 -30.2 70.27 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.077 174.958 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . 0.526 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 6.7 mtt -100.25 26.11 6.88 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.52 178.364 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.634 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.6 p-80 -63.81 -32.82 8.49 Favored Pre-proline 0 CA--C 1.537 0.445 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -177.726 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.616 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 49.2 Cg_exo -34.56 -35.49 0.1 OUTLIER 'Trans proline' 0 C--N 1.363 1.324 0 C-N-CA 122.316 2.011 . . . . 0.0 112.258 178.897 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.416 ' HB ' ' H ' ' A' ' 39' ' ' LEU . 13.2 m -77.9 -86.11 0.06 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.631 176.547 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.75 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -171.58 65.22 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.302 178.003 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.546 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -49.78 -33.67 17.1 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.452 179.655 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.592 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -50.5 -56.3 13.7 Favored Glycine 0 C--N 1.33 0.201 0 CA-C-N 115.973 -0.558 . . . . 0.0 114.046 -178.294 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.567 ' HE2' ' SD ' ' A' ' 46' ' ' MET . 2.0 tptm -77.54 -38.75 48.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 117.128 0.464 . . . . 0.0 111.952 -177.637 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.673 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 18.3 mt -54.33 -56.21 11.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 121.203 -0.199 . . . . 0.0 111.399 -178.698 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.807 ' HA ' HD12 ' A' ' 28' ' ' LEU . 5.8 t -47.69 -47.7 29.57 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 178.552 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.664 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -49.41 -65.48 2.75 Favored Glycine 0 N--CA 1.451 -0.331 0 CA-C-N 115.656 -0.702 . . . . 0.0 113.621 -179.826 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.656 ' HG3' HD12 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -54.48 -71.23 0.08 Allowed 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 -176.599 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.867 HD23 ' HB2' ' B' ' 7' ' ' ASN . 3.7 mp -66.87 6.17 0.54 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -176.621 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.695 HD21 ' HA3' ' A' ' 25' ' ' GLY . 0.2 OUTLIER -66.84 -1.57 4.1 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.051 0.453 . . . . 0.0 110.539 177.125 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.602 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 1.2 mm-40 -81.99 19.08 1.19 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.579 176.716 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.475 HD11 ' HE3' ' A' ' 68' ' ' LYS . 2.0 tt -82.28 165.1 2.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.175 -178.412 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.453 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 34.5 m-20 -70.42 160.95 31.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.731 -178.751 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.81 ' HA ' HD23 ' A' ' 55' ' ' LEU . 5.1 m120 -87.22 -30.29 21.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.872 177.375 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.6 t -73.86 -29.03 61.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.791 177.714 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.434 ' HG3' ' HB2' ' A' ' 51' ' ' ASP . 4.3 mt-10 -79.65 -29.26 40.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.555 178.804 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.81 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.5 OUTLIER -58.88 -46.49 87.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.976 0.417 . . . . 0.0 110.07 179.395 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.486 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 1.9 tm? -62.62 -41.76 99.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.192 178.623 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.502 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 0.9 OUTLIER -60.88 -34.98 75.45 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.537 178.897 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.57 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -68.91 -43.49 75.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.171 178.758 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.621 HD13 ' NH2' ' A' ' 27' ' ' ARG . 5.4 tp -69.79 -15.1 63.06 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.663 179.49 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.502 ' HG2' ' O ' ' A' ' 57' ' ' HIS . 4.6 pt-20 -102.53 -7.92 21.47 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.009 179.456 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.57 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -125.58 89.02 53.26 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.99 179.65 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -61.69 -32.92 86.94 Favored 'Trans proline' 0 C--N 1.343 0.261 0 C-N-CA 122.266 1.977 . . . . 0.0 111.997 179.538 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -78.05 -48.4 16.19 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.489 -179.683 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.413 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 15.5 m -69.37 -52.18 29.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.956 0.408 . . . . 0.0 111.397 -178.641 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.787 HD11 ' HB3' ' A' ' 31' ' ' LEU . 0.1 OUTLIER -58.1 -57.81 11.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.316 -178.53 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.686 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.5 OUTLIER -51.8 -33.81 37.3 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.492 -178.936 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.589 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 3.9 m -69.71 -35.96 75.5 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.142 0.496 . . . . 0.0 110.094 177.818 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.58 ' HG2' HD21 ' B' ' 6' ' ' LEU . 0.1 OUTLIER -66.09 -56.78 9.79 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.992 178.233 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.541 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 49.1 t -67.7 -15.18 19.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.489 178.585 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.655 ' O ' HG22 ' A' ' 73' ' ' VAL . 10.7 t70 -57.62 -49.42 76.49 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 176.362 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.443 ' O ' HG13 ' A' ' 75' ' ' VAL . 22.0 tt0 -68.34 -26.49 65.62 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.44 176.476 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.673 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -62.43 -43.64 98.33 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.183 179.699 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.655 HG22 ' O ' ' A' ' 70' ' ' ASP . 2.8 m -62.7 -30.58 49.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.941 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -68.99 -36.57 77.98 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.037 178.872 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.65 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -60.21 -32.31 50.32 Favored 'Isoleucine or valine' 0 C--O 1.231 0.121 0 CA-C-O 121.025 0.441 . . . . 0.0 110.175 179.218 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.75 ' HG ' ' HB3' ' A' ' 39' ' ' LEU . 2.6 tm? -71.75 -47.93 50.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.203 178.51 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -55.79 -36.99 68.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.51 179.343 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.49 -15.62 54.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.205 179.527 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.265 0 CA-C-O 120.804 0.335 . . . . 0.0 111.024 -179.618 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 3.6 m120 . . . . . 0 C--O 1.23 0.059 0 CA-C-O 120.814 0.34 . . . . 0.0 111.044 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.58 HD21 ' HG2' ' A' ' 68' ' ' LYS . 41.7 tp -76.41 -76.31 0.17 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.812 179.995 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 7' ' ' ASN . . . . . 0.867 ' HB2' HD23 ' A' ' 47' ' ' LEU . 2.1 t30 -83.4 122.27 77.03 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.74 179.341 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.472 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 5.2 Cg_exo -77.61 7.37 3.89 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 122.543 2.162 . . . . 0.0 111.858 179.381 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 9' ' ' ASN . . . . . 0.405 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 4.0 m120 -123.15 38.39 4.2 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.08 -179.593 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.57 89.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.852 -179.266 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.602 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 1.1 mmtp -125.71 129.96 50.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.828 177.952 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . 0.526 ' HG2' ' NZ ' ' A' ' 42' ' ' LYS . 6.6 mt-10 -46.63 170.72 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -176.282 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 13' ' ' PHE . . . . . 0.664 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.4 OUTLIER . . . . . 0 CA--C 1.519 -0.218 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.163 178.946 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.893 0.378 . . . . 0.0 110.839 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.996 -179.696 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.761 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 15.1 t . . . . . 0 CA--C 1.522 -0.107 0 N-CA-C 110.257 -0.275 . . . . 0.0 110.257 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.405 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.5 -36.25 75.69 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 176.566 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 16.8 t -67.77 -34.83 77.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.668 177.399 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.761 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 9.6 mtm -64.26 -37.34 87.12 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.006 177.696 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.791 HD11 ' HB3' ' A' ' 24' ' ' LEU . 2.0 mp -51.9 -47.67 64.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.096 179.364 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.26 -34.33 77.76 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.23 178.644 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.2 m -100.36 21.95 12.34 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.631 -178.63 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.691 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.012 179.568 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.691 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 1.2 tp10 . . . . . 0 CA--C 1.527 0.067 0 CA-C-O 120.667 0.27 . . . . 0.0 111.287 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.451 HE21 ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -51.02 -59.84 3.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.299 -179.92 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.469 ' H ' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -55.65 -21.47 18.16 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.514 -178.122 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.49 HE21 ' HG3' ' A' ' 23' ' ' MET . 5.4 tt0 -73.2 -79.24 0.08 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.989 0.423 . . . . 0.0 111.512 179.206 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . 0.669 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.32 -94.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.795 -0.638 . . . . 0.0 112.685 -176.935 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.791 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -62.02 -0.81 0.55 Allowed 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.434 0.902 . . . . 0.0 113.434 -175.363 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.533 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.86 -117.18 9.96 Favored Glycine 0 N--CA 1.444 -0.815 0 N-CA-C 108.474 -1.85 . . . . 0.0 108.474 -174.853 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.471 ' O ' HD13 ' A' ' 55' ' ' LEU . 0.7 OUTLIER -76.08 -68.73 0.55 Allowed 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 169.247 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.806 ' HG2' HD12 ' A' ' 59' ' ' LEU . 7.8 tpt180 -160.07 12.84 0.12 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 114.47 -1.241 . . . . 0.0 108.424 175.673 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.568 HD12 HD11 ' A' ' 32' ' ' ILE . 4.0 mm? -57.02 -78.89 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.622 -1.172 . . . . 0.0 113.623 -173.043 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.737 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -36.6 -48.92 1.85 Allowed Pre-proline 0 CA--C 1.537 0.452 0 N-CA-C 113.48 0.919 . . . . 0.0 113.48 -175.062 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.585 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 52.4 Cg_exo -56.62 -43.42 55.26 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.293 1.995 . . . . 0.0 113.719 -178.279 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.767 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.61 -46.08 64.06 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.169 0.509 . . . . 0.0 110.124 -178.242 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.681 HG21 HD12 ' A' ' 43' ' ' ILE . 0.3 OUTLIER -77.72 -12.38 13.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.453 179.105 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.625 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 11.2 tp60 -62.65 -38.67 91.19 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 176.654 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.73 -31.51 70.64 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.053 -0.976 . . . . 0.0 108.967 174.482 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . 0.485 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 7.6 mtt -100.27 27.43 5.68 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.35 178.023 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.814 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 1.7 p-80 -63.63 -32.88 8.78 Favored Pre-proline 0 CA--C 1.536 0.423 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -177.869 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.814 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 3.4 Cg_exo -35.3 -32.82 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.284 0 C-N-CA 122.687 2.258 . . . . 0.0 112.211 179.488 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.402 ' N ' ' O ' ' A' ' 36' ' ' HIS . 45.4 m -78.09 -86.83 0.06 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.101 -0.499 . . . . 0.0 109.811 176.637 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.668 ' O ' HG13 ' A' ' 43' ' ' ILE . 6.1 tp -171.47 56.08 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.512 178.175 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.478 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -39.87 -34.7 0.29 Allowed 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -179.865 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.606 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.58 -58.96 6.96 Favored Glycine 0 CA--C 1.519 0.289 0 CA-C-N 116.058 -0.519 . . . . 0.0 114.021 -179.049 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.945 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.3 OUTLIER -77.48 -30.35 53.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 117.068 0.434 . . . . 0.0 111.574 -178.356 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.681 HD12 HG21 ' A' ' 32' ' ' ILE . 5.1 mt -57.19 -58.21 6.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.116 -179.271 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.599 HG21 ' CD2' ' A' ' 29' ' ' PHE . 5.3 t -47.72 -45.89 29.23 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.984 0.421 . . . . 0.0 110.526 178.661 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.744 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -50.86 -66.94 2.16 Favored Glycine 0 N--CA 1.452 -0.279 0 CA-C-N 115.511 -0.768 . . . . 0.0 113.709 -179.28 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.737 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.37 -49.99 70.86 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 117.047 0.423 . . . . 0.0 111.527 -177.744 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.48 HD22 ' N ' ' A' ' 47' ' ' LEU . 2.9 mm? -76.49 3.33 11.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.542 -178.389 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.541 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.29 -10.29 41.08 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.991 0.424 . . . . 0.0 110.55 179.545 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.414 ' HG3' ' O ' ' B' ' 9' ' ' ASN . 3.1 mm-40 -82.39 19.71 1.19 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.508 178.438 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.424 HG23 ' O ' ' A' ' 51' ' ' ASP . 1.1 tt -83.57 164.32 2.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.024 -179.409 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.424 ' O ' HG23 ' A' ' 50' ' ' ILE . 1.0 OUTLIER -70.97 157.95 37.33 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.498 -179.404 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.862 ' HA ' HD23 ' A' ' 55' ' ' LEU . 4.4 m120 -86.1 -29.81 23.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.148 178.14 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -73.32 -33.77 65.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.232 0.539 . . . . 0.0 109.579 177.706 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.425 ' O ' ' SD ' ' A' ' 58' ' ' MET . 3.4 mt-10 -75.73 -29.25 58.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.688 178.945 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.862 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -58.46 -46.8 85.85 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.877 0.37 . . . . 0.0 110.213 -179.922 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.643 ' HA ' HD11 ' A' ' 59' ' ' LEU . 1.6 tt -59.5 -46.01 90.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.759 179.342 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.591 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 1.5 m80 -62.12 -16.91 55.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.548 -179.519 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.561 ' HB3' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -75.88 -56.53 4.59 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 -178.462 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.859 HD13 ' H ' ' A' ' 59' ' ' LEU . 0.0 OUTLIER -64.38 -12.0 38.38 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.269 -0.573 . . . . 0.0 110.678 179.953 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.594 ' N ' HD22 ' A' ' 59' ' ' LEU . 2.4 pt-20 -98.7 -12.29 21.15 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.899 179.283 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.537 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.3 OUTLIER -122.96 92.04 49.42 Favored Pre-proline 0 C--N 1.332 -0.186 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.079 179.886 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.435 ' O ' ' HB2' ' A' ' 66' ' ' ARG . 36.0 Cg_endo -64.49 -31.29 61.24 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.337 2.025 . . . . 0.0 112.009 179.409 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.62 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.63 -47.14 17.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.267 179.895 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.62 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 15.1 m -70.95 -55.55 8.12 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.503 -178.564 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.767 HD21 HD13 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -58.19 -61.52 2.5 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.613 -178.184 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.661 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -50.26 -31.21 13.55 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.94 -178.043 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.522 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.6 OUTLIER -68.17 -40.76 82.2 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.1 0.476 . . . . 0.0 110.294 177.949 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.493 ' HD3' ' CE ' ' A' ' 58' ' ' MET . 30.0 mtpt -65.86 -59.38 3.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.566 179.299 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.527 ' CG1' HG23 ' A' ' 32' ' ' ILE . 44.8 t -60.53 -20.99 22.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.486 179.86 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.598 ' O ' HG22 ' A' ' 73' ' ' VAL . 28.3 t0 -55.61 -48.87 74.18 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.219 -0.659 . . . . 0.0 109.219 176.55 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.594 ' HB3' HD13 ' B' ' 6' ' ' LEU . 1.1 tt0 -68.98 -26.69 65.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.936 176.845 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.675 ' O ' HG22 ' A' ' 75' ' ' VAL . . . -62.35 -53.36 56.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.022 179.871 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.643 ' HA ' HD13 ' A' ' 43' ' ' ILE . 2.8 m -54.23 -29.4 19.34 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 177.356 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.514 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -70.78 -36.43 73.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.466 179.856 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.675 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.5 m -56.23 -28.37 25.6 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 178.673 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.945 HD11 ' HB3' ' A' ' 42' ' ' LYS . 1.6 mm? -71.83 -51.63 21.5 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.126 176.846 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -52.81 -35.16 56.55 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.854 178.507 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -82.29 -21.46 36.15 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.185 178.173 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 9.4 t-80 . . . . . 0 N--CA 1.462 0.157 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.886 -179.373 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.456 -0.147 0 CA-C-O 120.784 0.326 . . . . 0.0 110.46 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.594 HD13 ' HB3' ' A' ' 71' ' ' GLU . 1.4 tp -75.23 -81.59 0.07 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.782 179.272 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 7' ' ' ASN . . . . . 0.593 HD22 ' H ' ' B' ' 9' ' ' ASN . 0.6 OUTLIER -79.83 120.16 79.08 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.193 179.883 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -76.01 3.09 6.42 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.196 1.93 . . . . 0.0 111.67 178.415 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 9' ' ' ASN . . . . . 0.593 ' H ' HD22 ' B' ' 7' ' ' ASN . 5.4 m120 -123.3 48.09 1.89 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.477 179.354 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . 0.737 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -59.44 96.83 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.801 -179.087 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.511 ' NZ ' ' HB3' ' B' ' 9' ' ' ASN . 8.3 mttp -125.19 133.78 52.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.076 178.189 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . 0.62 ' HG2' ' HE3' ' A' ' 42' ' ' LYS . 44.9 mt-10 -48.29 165.43 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.033 0.444 . . . . 0.0 111.982 -178.591 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 13' ' ' PHE . . . . . 0.744 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.8 OUTLIER . . . . . 0 C--N 1.33 -0.246 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.435 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.891 0.377 . . . . 0.0 110.998 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.412 ' HD1' ' HA ' ' B' ' 19' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.823 -179.771 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.744 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 7.2 t . . . . . 0 N--CA 1.456 -0.126 0 CA-C-O 120.64 0.257 . . . . 0.0 110.484 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.5 -36.89 76.92 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 176.948 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.0 t -68.93 -35.5 76.87 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.599 177.318 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.744 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.3 mtm -64.42 -36.05 82.9 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.972 177.506 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.727 ' HA ' ' HE2' ' A' ' 23' ' ' MET . 3.1 mp -52.15 -48.18 65.03 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.113 179.185 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.02 -33.86 76.78 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.15 178.846 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.7 m -101.5 25.53 8.3 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.715 -178.811 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.509 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.271 179.556 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.543 ' HG3' ' HB3' ' A' ' 22' ' ' GLN . 1.4 tp10 . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.653 0.263 . . . . 0.0 111.043 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.619 HE21 ' HB2' ' A' ' 21' ' ' LYS . 0.2 OUTLIER -59.23 -49.27 78.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.011 0.434 . . . . 0.0 110.764 -179.723 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.619 ' HB2' HE21 ' A' ' 20' ' ' GLN . 0.3 OUTLIER -56.82 -22.46 36.63 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.159 -179.303 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.543 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 4.1 tt0 -72.96 -76.5 0.12 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.946 0.403 . . . . 0.0 111.413 179.728 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . 0.727 ' HE2' ' HA ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.73 -95.76 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -176.854 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.634 HD23 HD11 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -62.14 1.64 0.29 Allowed 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -175.602 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.55 -116.49 9.09 Favored Glycine 0 N--CA 1.444 -0.816 0 N-CA-C 108.226 -1.95 . . . . 0.0 108.226 -174.376 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.583 ' HB3' ' HB2' ' A' ' 55' ' ' LEU . 1.9 mp0 -75.75 -69.18 0.51 Allowed 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 168.814 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.94 ' HG3' HD21 ' A' ' 31' ' ' LEU . 23.3 tpt180 -160.25 8.9 0.1 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.132 -1.394 . . . . 0.0 107.458 175.416 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 1.002 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -58.28 -74.82 0.06 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.398 -1.274 . . . . 0.0 113.879 -172.259 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.63 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -38.54 -47.0 3.18 Favored Pre-proline 0 CA--C 1.536 0.441 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 -175.229 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.483 ' HD2' ' O ' ' A' ' 27' ' ' ARG . 52.2 Cg_exo -57.5 -42.04 65.41 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.172 1.915 . . . . 0.0 113.398 -179.126 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.94 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.79 -43.26 69.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.18 0.514 . . . . 0.0 109.833 -179.067 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.679 HG21 HD12 ' A' ' 43' ' ' ILE . 0.4 OUTLIER -77.01 -15.57 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.06 177.901 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.649 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 4.9 tt0 -63.17 -35.08 79.11 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 177.101 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.26 -30.19 65.99 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.011 -0.995 . . . . 0.0 108.651 174.676 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . 0.51 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 7.7 mtt -100.12 24.66 8.35 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.881 177.539 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.649 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -64.65 -31.46 5.68 Favored Pre-proline 0 CA--C 1.535 0.377 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.694 -178.213 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.555 ' CD ' ' N ' ' A' ' 36' ' ' HIS . 64.5 Cg_exo -38.61 -27.65 0.12 Allowed 'Trans proline' 0 C--N 1.363 1.313 0 C-N-CA 121.98 1.786 . . . . 0.0 111.9 178.244 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.858 HG22 HD12 ' A' ' 39' ' ' LEU . 13.6 m -77.66 -95.32 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 175.8 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.858 HD12 HG22 ' A' ' 38' ' ' THR . 2.2 mp -154.59 42.34 0.49 Allowed 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 177.662 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -42.19 105.99 0.05 Allowed 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 178.065 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.63 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . 170.49 -63.75 0.17 Allowed Glycine 0 N--CA 1.447 -0.576 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.883 -176.846 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.698 ' HE3' ' HG2' ' B' ' 12' ' ' GLU . 0.0 OUTLIER -77.86 -30.6 50.99 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.745 0.307 . . . . 0.0 110.658 178.773 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.776 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 60.0 mt -54.05 -62.22 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.244 -179.711 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 1.002 ' HA ' HD22 ' A' ' 28' ' ' LEU . 9.9 t -47.1 -41.14 16.69 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.185 -179.471 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.704 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -53.3 -63.71 4.83 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.854 178.769 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.755 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.63 -51.06 68.47 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.686 0.279 . . . . 0.0 111.476 -178.548 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.494 ' HB2' HD21 ' A' ' 28' ' ' LEU . 2.3 mm? -78.67 4.8 12.64 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.772 -178.044 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.688 ' HB3' ' HD2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -66.25 -11.74 52.08 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.919 0.39 . . . . 0.0 110.62 179.371 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.443 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 3.2 mm-40 -74.64 13.5 0.61 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.265 177.605 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.525 HD11 ' HE3' ' A' ' 68' ' ' LYS . 0.1 OUTLIER -84.87 156.84 3.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.008 -179.66 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.457 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 1.1 m-20 -71.36 156.36 39.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.744 -179.817 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.822 ' HA ' HD23 ' A' ' 55' ' ' LEU . 3.1 m120 -82.41 -22.8 35.21 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 121.266 0.555 . . . . 0.0 109.598 176.423 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -74.61 -37.33 62.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.325 0.583 . . . . 0.0 109.794 176.807 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.07 -22.57 58.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.304 179.348 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.822 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.4 OUTLIER -63.04 -48.17 79.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.882 178.56 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.526 ' O ' ' HG3' ' A' ' 60' ' ' GLU . 53.1 tp -55.28 -43.79 75.08 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.347 179.01 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -58.41 -41.17 84.34 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.056 179.226 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.521 ' HB3' ' HG ' ' A' ' 65' ' ' LEU . 24.4 mmt -60.12 -36.69 78.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.058 179.687 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.772 HD12 ' NE ' ' A' ' 27' ' ' ARG . 8.3 tt -70.9 -19.83 62.56 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.286 -179.19 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.526 ' HG3' ' O ' ' A' ' 56' ' ' LEU . 13.7 mt-10 -106.53 -3.72 20.52 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 -178.607 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.539 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.3 OUTLIER -122.52 83.08 47.44 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 120.602 0.239 . . . . 0.0 111.213 -179.447 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -59.94 -31.93 94.38 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.312 2.008 . . . . 0.0 111.945 179.237 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -78.09 -49.01 14.76 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.498 -179.793 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 47.4 m -70.58 -52.78 19.22 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.889 0.376 . . . . 0.0 111.439 -178.63 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.889 HD21 HD13 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -57.93 -62.24 1.95 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.26 -178.704 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.627 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.5 OUTLIER -50.71 -35.77 32.9 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.157 -177.831 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.61 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 4.2 m -67.96 -36.21 79.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.292 0.568 . . . . 0.0 110.049 178.127 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.525 ' HE3' HD11 ' A' ' 50' ' ' ILE . 9.7 ttpt -66.12 -57.67 7.15 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.11 178.556 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.621 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 42.0 t -65.21 -15.64 18.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.373 178.572 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.61 ' HB3' ' O ' ' A' ' 67' ' ' SER . 9.4 t70 -57.3 -48.98 77.55 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 176.313 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.558 ' HB3' HD13 ' B' ' 6' ' ' LEU . 4.5 tt0 -68.6 -21.97 64.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.673 176.515 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.776 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -63.95 -51.17 65.62 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.817 179.597 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.589 HG22 ' O ' ' A' ' 70' ' ' ASP . 2.6 m -56.15 -29.17 26.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 176.851 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.523 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -70.86 -32.47 69.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.055 178.64 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.717 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.6 m -57.06 -33.48 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 178.515 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.732 HD13 ' HB2' ' A' ' 39' ' ' LEU . 39.0 mt -66.56 -48.3 70.1 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 175.96 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 17.1 mm100 -54.72 -36.79 65.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.315 178.916 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.89 -20.69 38.32 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.159 178.57 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 . . . . . 0 C--N 1.332 -0.165 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.902 -179.381 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' B' B ' 5' ' ' ASN . . . . . 0.432 ' HB3' ' HG2' ' A' ' 71' ' ' GLU . 0.3 OUTLIER . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.792 0.33 . . . . 0.0 111.029 . . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.558 HD13 ' HB3' ' A' ' 71' ' ' GLU . 1.4 tp -74.45 -77.85 0.11 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.014 -179.75 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 7' ' ' ASN . . . . . 0.654 HD22 ' H ' ' B' ' 9' ' ' ASN . 2.1 t30 -83.71 138.33 40.88 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.026 179.867 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.481 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 5.6 Cg_exo -79.86 -7.78 14.44 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.75 2.3 . . . . 0.0 111.928 179.234 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 9' ' ' ASN . . . . . 0.654 ' H ' HD22 ' B' ' 7' ' ' ASN . 64.8 m-20 -123.38 56.31 1.2 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.185 -179.76 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . 0.755 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.8 98.94 0.08 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.707 179.507 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.579 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.0 OUTLIER -124.99 156.47 38.05 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.471 178.446 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . 0.698 ' HG2' ' HE3' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -56.25 166.49 0.82 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.764 0.316 . . . . 0.0 111.416 -179.656 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' B' B ' 13' ' ' PHE . . . . . 0.704 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.1 t80 . . . . . 0 N--CA 1.463 0.176 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.681 179.84 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.539 ' HG3' ' NE2' ' A' ' 20' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.812 0.339 . . . . 0.0 110.849 . . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.688 ' HD2' ' HB3' ' A' ' 48' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.936 -179.86 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.741 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 5.8 t . . . . . 0 CA--C 1.523 -0.091 0 CA-C-O 120.536 0.208 . . . . 0.0 110.886 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.23 -33.66 71.28 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 177.707 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -75.09 -34.98 61.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.94 177.574 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.741 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 9.0 mtm -64.42 -36.78 85.28 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.898 177.869 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.621 HD11 ' HB3' ' A' ' 24' ' ' LEU . 1.2 mp -52.59 -56.28 16.39 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.906 178.626 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.29 -25.27 66.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.881 178.202 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.6 m -101.61 23.7 10.83 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.834 -178.534 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.724 ' HB1' ' HB2' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.753 -0.203 . . . . 0.0 111.161 179.545 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.724 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 1.9 mm-40 . . . . . 0 N--CA 1.448 -0.575 0 CA-C-O 120.514 0.197 . . . . 0.0 110.886 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.644 HE22 ' HG3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -46.43 -61.0 2.0 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.223 -177.73 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.538 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -56.32 -25.02 47.44 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.293 -179.32 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.495 ' OE1' ' HG3' ' A' ' 23' ' ' MET . 2.9 tt0 -73.44 -75.56 0.14 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.844 0.354 . . . . 0.0 111.52 179.468 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . 0.617 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.15 -96.58 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -176.309 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.621 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -61.96 0.73 0.35 Allowed 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 -175.532 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 65.0 -117.29 10.11 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 108.421 -1.872 . . . . 0.0 108.421 -174.322 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.433 ' O ' HD13 ' A' ' 24' ' ' LEU . 1.2 mp0 -75.91 -68.54 0.57 Allowed 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 169.401 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.971 ' HG2' HD22 ' A' ' 59' ' ' LEU . 1.7 tpt180 -160.06 11.75 0.12 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.216 175.537 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.485 ' O ' HG13 ' A' ' 32' ' ' ILE . 4.1 mm? -57.2 -78.45 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.608 -1.178 . . . . 0.0 113.49 -173.302 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.716 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -35.05 -48.33 1.04 Allowed Pre-proline 0 CA--C 1.539 0.521 0 N-CA-C 113.642 0.978 . . . . 0.0 113.642 -175.517 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.545 ' HG2' ' HD2' ' A' ' 27' ' ' ARG . 46.8 Cg_exo -59.69 -42.16 49.11 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 122.367 2.045 . . . . 0.0 113.736 -178.204 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.784 HD22 ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.61 -44.54 67.06 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 121.131 0.491 . . . . 0.0 109.97 -178.474 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.529 HG23 ' CG1' ' A' ' 69' ' ' VAL . 0.2 OUTLIER -76.9 -13.0 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.968 178.179 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.612 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 49.6 tp60 -62.33 -37.47 85.72 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 176.75 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.47 -32.5 71.46 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.139 174.749 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . 0.54 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 7.0 mtt -100.13 28.75 4.68 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.203 177.85 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.612 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.2 OUTLIER -63.16 -32.15 8.1 Favored Pre-proline 0 CA--C 1.535 0.402 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -177.429 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.567 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 60.0 Cg_exo -36.65 -32.85 0.13 Allowed 'Trans proline' 0 C--N 1.362 1.275 0 C-N-CA 122.083 1.855 . . . . 0.0 112.27 179.23 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.511 HG22 HD12 ' A' ' 76' ' ' LEU . 86.6 m -78.26 -88.08 0.05 Allowed 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.8 176.836 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.681 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 0.1 OUTLIER -171.35 61.17 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.447 178.203 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.476 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -44.99 -34.24 2.36 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.848 0.356 . . . . 0.0 111.616 179.661 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.639 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -50.94 -58.16 9.88 Favored Glycine 0 C--N 1.33 0.243 0 CA-C-N 115.989 -0.551 . . . . 0.0 113.867 -178.995 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.494 ' H ' HD12 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -77.86 -34.35 51.74 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -177.867 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.65 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 36.1 mt -55.98 -55.43 18.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.715 -0.22 . . . . 0.0 111.481 -179.008 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.566 HG21 ' CD2' ' A' ' 29' ' ' PHE . 6.1 t -47.56 -44.18 25.91 Favored 'General case' 0 CA--C 1.522 -0.119 0 CA-C-O 121.006 0.432 . . . . 0.0 110.135 178.637 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.803 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -49.65 -65.39 2.85 Favored Glycine 0 N--CA 1.448 -0.501 0 CA-C-N 115.312 -0.858 . . . . 0.0 113.464 -179.862 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.615 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.33 -50.72 68.88 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -177.276 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.5 HD22 ' N ' ' A' ' 47' ' ' LEU . 2.9 mm? -79.06 6.2 10.04 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -177.917 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.559 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.21 -7.65 19.55 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.984 0.421 . . . . 0.0 110.622 179.195 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.436 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 3.3 mt-10 -81.96 16.8 1.75 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.664 178.437 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -83.16 158.82 3.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.816 -179.514 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -70.59 160.05 33.23 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.02 0.438 . . . . 0.0 111.838 -178.089 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.943 ' HA ' HD23 ' A' ' 55' ' ' LEU . 4.9 m120 -83.67 -31.39 26.17 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.448 178.738 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.1 t -74.01 -34.27 64.1 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.387 0.613 . . . . 0.0 109.523 177.516 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.442 ' OE2' ' HE3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -75.58 -28.65 59.03 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.645 179.367 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.943 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -59.34 -47.07 86.79 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 120.923 0.392 . . . . 0.0 110.003 179.124 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.684 ' HA ' HD21 ' A' ' 59' ' ' LEU . 2.2 tm? -56.33 -48.04 77.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.926 -179.844 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.45 ' O ' ' HB2' ' A' ' 61' ' ' SER . 15.4 t60 -58.05 -24.67 59.33 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.918 -179.119 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.631 ' HE2' ' HA ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -73.86 -58.17 3.48 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -177.542 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.971 HD22 ' HG2' ' A' ' 27' ' ' ARG . 2.2 pt? -65.59 -6.03 9.9 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.962 -179.024 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.542 ' HG3' HD13 ' A' ' 56' ' ' LEU . 13.4 mm-40 -106.68 -10.86 15.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.679 177.455 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.572 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.5 OUTLIER -122.5 97.83 44.3 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.137 179.75 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -64.06 -30.53 66.07 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.201 1.934 . . . . 0.0 112.028 179.07 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -78.22 -51.26 10.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.599 -179.7 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.444 ' HB3' ' HB3' ' A' ' 61' ' ' SER . 33.2 t -69.07 -44.65 72.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.686 -178.033 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.784 ' HG ' HD22 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -69.86 -62.14 1.5 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.986 -177.136 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.667 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -51.15 -29.28 13.13 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.962 -177.646 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.476 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.4 OUTLIER -69.59 -39.53 77.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.138 0.494 . . . . 0.0 110.233 178.013 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.442 ' HE3' ' OE2' ' A' ' 54' ' ' GLU . 5.0 mtmm -65.49 -61.05 2.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.236 178.862 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.529 ' CG1' HG23 ' A' ' 32' ' ' ILE . 53.0 t -61.78 -20.95 24.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.942 -179.416 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.603 ' O ' HG22 ' A' ' 73' ' ' VAL . 16.5 t70 -54.63 -51.76 64.39 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 176.458 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.497 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 0.5 OUTLIER -69.23 -26.3 64.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.017 177.003 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.686 ' O ' HG22 ' A' ' 75' ' ' VAL . . . -61.17 -48.2 82.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.04 179.952 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.603 HG22 ' O ' ' A' ' 70' ' ' ASP . 2.6 m -58.48 -31.58 43.66 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 177.541 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.497 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -68.16 -37.92 81.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.145 178.952 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.686 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -60.61 -31.17 48.38 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.217 0 CA-C-O 120.919 0.39 . . . . 0.0 110.225 179.511 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.681 ' HG ' ' HB3' ' A' ' 39' ' ' LEU . 2.3 tm? -71.41 -49.54 40.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.215 178.803 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 9.7 mm100 -57.62 -37.64 73.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.457 179.214 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.29 -21.78 39.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.905 -0.588 . . . . 0.0 111.067 179.293 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 11.9 t-80 . . . . . 0 C--N 1.331 -0.237 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.025 -179.534 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 11.9 m120 . . . . . 0 C--O 1.232 0.169 0 CA-C-O 120.86 0.362 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.432 HD12 ' HA ' ' B' ' 6' ' ' LEU . 7.5 tp -68.87 -77.53 0.08 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.112 178.182 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 7' ' ' ASN . . . . . 0.495 HD22 ' H ' ' B' ' 9' ' ' ASN . 1.1 t30 -92.08 127.6 48.72 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.327 177.768 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 6.6 Cg_exo -73.77 -2.12 11.76 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.281 1.987 . . . . 0.0 112.177 -179.717 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 9' ' ' ASN . . . . . 0.495 ' H ' HD22 ' B' ' 7' ' ' ASN . 8.3 m-20 -123.76 40.31 3.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.042 -179.774 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . 0.615 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -53.1 92.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.508 -179.383 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.497 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -121.37 136.23 54.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.946 179.125 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -47.67 168.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -177.905 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 13' ' ' PHE . . . . . 0.803 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.6 OUTLIER . . . . . 0 C--O 1.233 0.185 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.783 179.171 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.644 ' HG3' HE22 ' A' ' 20' ' ' GLN . 1.8 mppt? . . . . . 0 C--O 1.231 0.12 0 CA-C-O 121.012 0.434 . . . . 0.0 110.556 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.497 ' CE2' ' HG2' ' B' ' 11' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.101 -178.922 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.761 HG21 ' HB3' ' A' ' 29' ' ' PHE . 9.9 t . . . . . 0 CA--C 1.522 -0.122 0 CA-C-O 120.637 0.256 . . . . 0.0 110.559 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.509 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.18 -36.57 75.56 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 177.175 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 35.2 t -71.4 -34.19 70.15 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.625 177.003 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.736 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 5.3 mtm -64.32 -34.31 77.84 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 177.347 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.633 HD11 ' HB3' ' A' ' 24' ' ' LEU . 3.4 mp -52.54 -52.61 53.97 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.902 178.481 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.09 -25.51 67.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.895 178.414 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.6 p -101.93 13.23 35.37 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.846 -178.676 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.777 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 CA--C 1.534 0.339 0 CA-C-O 120.528 0.204 . . . . 0.0 111.29 -179.871 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.777 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.205 0 CA-C-O 120.912 0.387 . . . . 0.0 110.676 . . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -47.07 -67.27 0.29 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.521 -179.14 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.59 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.79 -21.21 18.12 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.814 -177.706 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.59 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 10.3 tt0 -73.52 -78.32 0.1 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.006 0.431 . . . . 0.0 111.254 179.177 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . 0.587 ' HE2' ' HB3' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -69.25 -95.99 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -176.909 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.649 ' HB2' ' HG2' ' A' ' 30' ' ' PRO . 0.3 OUTLIER -61.63 -1.32 0.56 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -175.323 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.597 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.38 -117.41 10.61 Favored Glycine 0 CA--C 1.505 -0.569 0 N-CA-C 108.262 -1.935 . . . . 0.0 108.262 -174.6 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.477 ' O ' HD22 ' A' ' 55' ' ' LEU . 0.6 OUTLIER -76.45 -67.59 0.68 Allowed 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 107.143 -1.428 . . . . 0.0 107.143 168.049 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.69 ' HB2' HD13 ' A' ' 55' ' ' LEU . 1.6 tpt180 -159.71 10.54 0.12 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 114.364 -1.289 . . . . 0.0 108.614 175.302 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.513 HD12 ' HA ' ' A' ' 44' ' ' THR . 3.8 mm? -56.91 -84.84 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.655 -1.157 . . . . 0.0 113.929 -172.924 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.761 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -31.14 -51.09 0.43 Allowed Pre-proline 0 CA--C 1.539 0.535 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -174.833 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.649 ' HG2' ' HB2' ' A' ' 24' ' ' LEU . 54.1 Cg_exo -56.43 -42.75 62.37 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 122.238 1.959 . . . . 0.0 113.875 -178.178 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.662 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.12 -44.06 66.38 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.112 0.482 . . . . 0.0 110.375 -178.232 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.73 HG21 HD12 ' A' ' 43' ' ' ILE . 0.0 OUTLIER -72.55 -20.64 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.708 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.127 179.254 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 62.8 tp60 -62.79 -31.45 72.43 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 175.684 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.33 -20.14 55.34 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 114.99 -1.004 . . . . 0.0 109.984 176.942 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . 0.602 ' HG3' ' HA ' ' A' ' 32' ' ' ILE . 2.5 mtt -98.49 7.06 46.65 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.117 178.679 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -77.29 163.46 64.45 Favored Pre-proline 0 N--CA 1.447 -0.621 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.427 -179.75 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -100.85 90.05 0.08 OUTLIER 'Cis proline' 0 C--N 1.353 0.769 0 C-N-CA 124.535 -1.027 . . . . 0.0 113.49 4.078 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 6.5 m -98.99 -70.36 0.73 Allowed 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 176.163 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 1.035 HD23 HD12 ' A' ' 76' ' ' LEU . 2.9 tp -171.76 28.62 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.157 176.887 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -33.6 -38.96 0.05 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.046 -179.272 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.584 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -52.26 -53.0 33.3 Favored Glycine 0 C--N 1.33 0.238 0 C-N-CA 121.052 -0.594 . . . . 0.0 113.048 179.61 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.95 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -78.16 -34.14 49.9 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 122.676 -0.308 . . . . 0.0 111.427 -179.725 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.829 HD13 ' HA ' ' A' ' 73' ' ' VAL . 1.8 mt -54.14 -57.98 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-O 120.583 0.23 . . . . 0.0 110.789 179.979 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.513 ' HA ' HD12 ' A' ' 28' ' ' LEU . 10.0 t -47.76 -46.03 29.73 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.078 178.558 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.581 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -50.15 -66.49 2.32 Favored Glycine 0 N--CA 1.449 -0.462 0 CA-C-N 115.608 -0.724 . . . . 0.0 113.214 179.838 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.505 ' HB2' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.47 -51.68 66.14 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -177.648 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.486 HD12 ' HB2' ' B' ' 7' ' ' ASN . 2.8 mm? -79.35 8.33 6.33 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -177.975 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.581 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.13 -6.82 14.57 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.08 0.467 . . . . 0.0 110.334 178.676 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.471 ' OE2' ' HB3' ' B' ' 11' ' ' LYS . 3.3 mt-10 -81.66 16.06 1.91 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.607 178.698 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.84 HD11 ' NZ ' ' A' ' 68' ' ' LYS . 0.9 OUTLIER -83.18 160.25 3.58 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.633 -179.729 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.529 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 34.4 m-20 -70.99 154.98 41.36 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.97 0.414 . . . . 0.0 112.036 -178.16 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.833 ' HA ' HD23 ' A' ' 55' ' ' LEU . 1.1 t-20 -82.99 -31.08 27.72 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.034 177.995 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.2 t -73.97 -33.46 63.87 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.344 0.592 . . . . 0.0 109.477 177.592 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.529 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -75.38 -27.82 59.25 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.467 179.074 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.833 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -59.64 -47.82 84.08 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.189 179.432 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.449 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 12.2 tp -56.54 -46.27 80.76 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.623 179.361 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -59.75 -32.67 70.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.28 179.882 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.539 ' SD ' ' HE2' ' A' ' 68' ' ' LYS . 32.0 mmt -60.87 -51.61 68.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.432 -179.4 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.585 ' HG ' ' NH2' ' A' ' 27' ' ' ARG . 0.2 OUTLIER -61.61 -22.23 65.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.081 -179.057 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 56' ' ' LEU . 2.2 mt-10 -99.75 -3.64 32.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.8 179.954 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.585 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 16.0 m -122.72 80.64 48.57 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.52 179.617 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.37 -35.69 95.97 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.147 1.898 . . . . 0.0 111.996 179.85 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.579 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.67 -45.19 21.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.718 -179.466 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.579 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 7.0 m -70.47 -51.98 25.27 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.952 0.406 . . . . 0.0 111.33 -178.079 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.626 ' HG ' ' N ' ' A' ' 66' ' ' ARG . 0.3 OUTLIER -58.12 -61.06 2.83 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.672 -178.755 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.626 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 1.1 ttp180 -48.39 -33.33 8.95 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.221 -177.436 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.443 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 8.2 t -61.67 -44.23 97.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.118 0.485 . . . . 0.0 110.277 178.307 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.84 ' NZ ' HD11 ' A' ' 50' ' ' ILE . 13.6 mtpp -65.92 -63.03 1.18 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.806 179.451 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.593 ' CG1' HG23 ' A' ' 32' ' ' ILE . 55.2 t -58.77 -19.45 14.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.089 -179.496 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.59 ' O ' HG22 ' A' ' 73' ' ' VAL . 20.4 t70 -58.19 -48.89 78.91 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 175.709 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.47 ' HB3' HD13 ' B' ' 6' ' ' LEU . 3.5 tt0 -69.03 -27.23 65.48 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.817 176.603 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.598 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -60.31 -54.39 46.31 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.178 179.485 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.829 ' HA ' HD13 ' A' ' 43' ' ' ILE . 3.3 m -55.08 -29.62 22.65 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 177.932 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.432 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -73.57 -36.37 65.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.618 179.794 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.569 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.1 m -56.26 -31.17 31.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 N-CA-C 109.713 -0.476 . . . . 0.0 109.713 179.493 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 1.035 HD12 HD23 ' A' ' 39' ' ' LEU . 4.4 mm? -72.21 -48.69 41.08 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.861 176.552 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 34.9 mm-40 -50.82 -34.38 27.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.316 177.906 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -82.18 -29.7 31.35 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.55 176.911 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 16.4 t-80 . . . . . 0 N--CA 1.462 0.169 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.979 -179.913 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 3.0 m120 . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.875 0.369 . . . . 0.0 110.433 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.47 HD13 ' HB3' ' A' ' 71' ' ' GLU . 1.9 tp -64.8 -83.19 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.472 178.949 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 7' ' ' ASN . . . . . 0.486 ' HB2' HD12 ' A' ' 47' ' ' LEU . 0.4 OUTLIER -82.47 113.06 41.67 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.441 178.301 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -66.41 -5.05 11.84 Favored 'Trans proline' 0 N--CA 1.463 -0.296 0 C-N-CA 122.122 1.882 . . . . 0.0 112.242 -179.728 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 69.0 m-20 -123.74 38.52 4.17 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.465 179.139 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . 0.505 ' HB1' ' HB2' ' A' ' 46' ' ' MET . . . -53.91 94.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.87 -178.641 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.584 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -115.01 131.59 56.87 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.839 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . 0.539 ' HG2' ' HD2' ' A' ' 42' ' ' LYS . 6.7 mt-10 -50.0 178.97 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -177.204 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 13' ' ' PHE . . . . . 0.46 ' CE1' ' HG ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.519 -0.218 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.853 179.725 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.152 0 CA-C-O 121.075 0.464 . . . . 0.0 110.974 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.584 ' CE2' ' HG2' ' B' ' 11' ' ' LYS . 2.1 t80 . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.067 -179.511 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.77 HG21 ' HB3' ' A' ' 29' ' ' PHE . 9.8 t . . . . . 0 N--CA 1.456 -0.151 0 CA-C-O 120.685 0.279 . . . . 0.0 110.435 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.44 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.22 -36.23 75.05 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 177.068 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 5.4 t -68.98 -35.74 77.06 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.746 177.101 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.753 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 5.4 mtm -64.39 -35.92 82.46 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.943 177.769 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.813 HD11 ' HB3' ' A' ' 24' ' ' LEU . 4.2 mp -52.31 -48.48 65.37 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.07 178.921 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.97 -30.17 70.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.836 178.312 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.9 p -101.71 21.56 14.26 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.716 -179.012 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.622 ' HB1' ' CB ' ' A' ' 19' ' ' GLU . . . . . . . . 0 CA--C 1.532 0.277 0 CA-C-O 120.555 0.217 . . . . 0.0 111.319 179.875 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.622 ' CB ' ' HB1' ' A' ' 15' ' ' ALA . 2.1 mm-40 . . . . . 0 N--CA 1.449 -0.483 0 CA-C-O 120.604 0.24 . . . . 0.0 110.727 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.596 HE22 ' HG2' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -46.04 -70.1 0.11 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.122 -179.078 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.515 ' H ' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -55.6 -18.59 7.99 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.651 -177.668 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.541 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 10.8 tp60 -73.95 -79.22 0.09 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.909 0.385 . . . . 0.0 111.457 178.223 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . 0.698 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.17 -94.9 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.984 -0.553 . . . . 0.0 112.412 -176.775 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.813 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -59.45 0.52 0.12 Allowed 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -176.588 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.556 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.36 -118.85 13.69 Favored Glycine 0 CA--C 1.501 -0.84 0 N-CA-C 107.979 -2.048 . . . . 0.0 107.979 -174.384 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.558 ' HG2' HD22 ' A' ' 52' ' ' ASN . 29.0 mt-10 -77.26 -66.01 0.88 Allowed 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 167.659 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.825 ' HB2' HD13 ' A' ' 55' ' ' LEU . 2.5 tpt180 -160.22 9.51 0.1 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.095 -1.411 . . . . 0.0 108.472 174.76 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.94 HD12 ' HA ' ' A' ' 44' ' ' THR . 3.6 mm? -56.99 -80.42 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.732 -1.122 . . . . 0.0 113.681 -172.978 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.77 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -34.82 -48.71 1.01 Allowed Pre-proline 0 CA--C 1.538 0.505 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -174.445 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.665 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 50.5 Cg_exo -57.95 -42.85 54.1 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.15 1.9 . . . . 0.0 113.573 -178.972 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.604 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.86 -47.4 53.26 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.664 -178.328 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.639 ' HA ' ' HG3' ' A' ' 35' ' ' MET . 0.0 OUTLIER -69.76 -18.22 21.91 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 C-N-CA 120.614 -0.434 . . . . 0.0 109.938 178.86 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.478 ' HB3' ' O ' ' A' ' 30' ' ' PRO . 36.4 tp60 -62.88 -34.14 76.76 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 174.136 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -74.16 -19.12 60.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 114.775 -1.102 . . . . 0.0 110.128 176.816 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . 0.639 ' HG3' ' HA ' ' A' ' 32' ' ' ILE . 0.1 OUTLIER -98.66 -3.42 36.08 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.892 178.22 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.435 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -62.51 166.05 7.98 Favored Pre-proline 0 N--CA 1.448 -0.568 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.247 -179.951 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.405 ' HA ' ' CB ' ' A' ' 36' ' ' HIS . 69.6 Cg_endo -103.7 61.3 0.62 Allowed 'Cis proline' 0 N--CA 1.455 -0.747 0 C-N-CA 124.69 -0.962 . . . . 0.0 113.959 5.158 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 52.7 m -77.04 -73.8 0.28 Allowed 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 176.793 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.584 HD13 HD11 ' A' ' 76' ' ' LEU . 0.2 OUTLIER -171.95 49.5 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.848 176.428 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.504 ' CB ' ' HB ' ' A' ' 32' ' ' ILE . . . -41.47 -34.63 0.57 Allowed 'General case' 0 N--CA 1.462 0.13 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.582 179.907 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -54.3 -71.99 0.62 Allowed Glycine 0 N--CA 1.452 -0.28 0 CA-C-N 116.083 -0.508 . . . . 0.0 113.692 -179.207 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.541 ' O ' ' HG2' ' A' ' 46' ' ' MET . 0.0 OUTLIER -57.57 -41.85 81.91 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -177.074 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.641 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 22.7 mt -53.31 -57.4 4.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 121.079 0.466 . . . . 0.0 110.195 179.262 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.94 ' HA ' HD12 ' A' ' 28' ' ' LEU . 1.3 m -47.64 -45.78 28.19 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.247 177.475 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.744 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -51.25 -60.7 6.92 Favored Glycine 0 N--CA 1.445 -0.71 0 CA-C-N 115.06 -0.973 . . . . 0.0 113.231 -179.623 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.622 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -54.41 -59.47 4.65 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.746 0.307 . . . . 0.0 111.779 -177.473 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.793 HD23 ' HB2' ' B' ' 7' ' ' ASN . 1.1 mp -79.9 18.23 0.84 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.162 0.431 . . . . 0.0 112.162 -176.742 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.599 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.01 -6.94 14.42 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.301 0.572 . . . . 0.0 109.582 175.659 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.515 ' OE1' ' HB3' ' B' ' 9' ' ' ASN . 2.6 mt-10 -93.24 25.35 3.37 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.756 179.462 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.542 HG22 ' CD ' ' A' ' 26' ' ' GLU . 3.5 tt -83.0 176.23 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.782 -179.72 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.745 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 7.0 m-20 -73.53 124.47 25.94 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.705 0.261 . . . . 0.0 111.705 179.441 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.673 ' HA ' HD23 ' A' ' 55' ' ' LEU . 3.7 t-20 -66.14 -30.54 71.05 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.448 0.642 . . . . 0.0 109.722 177.521 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.6 m -73.31 -33.19 65.03 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.838 177.612 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.745 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 3.9 mm-40 -76.96 -24.4 52.31 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.449 178.81 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.825 HD13 ' HB2' ' A' ' 27' ' ' ARG . 0.6 OUTLIER -59.08 -47.93 83.46 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 179.515 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.44 HD22 ' HA ' ' A' ' 56' ' ' LEU . 0.3 OUTLIER -59.45 -42.33 91.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.779 178.174 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.531 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 26.6 m-70 -69.27 -19.03 63.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.243 179.321 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.551 ' HG2' ' O ' ' A' ' 54' ' ' GLU . 23.8 mmt -68.66 -58.97 3.48 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.053 -179.576 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.698 HD13 ' NE ' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -61.51 -21.02 63.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.103 -179.577 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.531 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 0.6 OUTLIER -91.62 -9.57 43.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.085 179.817 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.552 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.5 OUTLIER -122.92 85.25 50.41 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.799 179.696 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_exo -59.88 -33.52 95.85 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.398 2.065 . . . . 0.0 112.292 -179.666 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.636 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.22 -45.8 22.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.297 -179.395 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.636 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 10.7 m -70.62 -54.16 13.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.83 0.348 . . . . 0.0 111.328 -178.695 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.632 ' HG ' ' N ' ' A' ' 66' ' ' ARG . 0.3 OUTLIER -57.82 -61.99 2.13 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.866 -178.286 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.632 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -48.53 -35.29 12.92 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.055 -177.256 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.15 -44.01 97.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.155 0.502 . . . . 0.0 110.154 178.45 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.514 ' HZ1' HD11 ' A' ' 50' ' ' ILE . 29.4 mtpt -66.3 -62.21 1.6 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.114 179.619 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.514 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 45.4 t -59.8 -21.29 21.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.187 -178.871 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.598 ' O ' HG22 ' A' ' 73' ' ' VAL . 18.5 t70 -58.34 -48.52 80.31 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 176.412 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.513 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 0.8 OUTLIER -69.04 -25.61 64.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.597 176.557 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.641 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -62.2 -53.15 59.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.015 -179.908 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.598 HG22 ' O ' ' A' ' 70' ' ' ASP . 11.1 m -57.41 -26.28 26.0 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 177.684 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.513 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -73.18 -36.84 66.64 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.187 178.618 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.564 HG13 ' HA ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.04 -37.65 62.71 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.147 0 CA-C-O 120.896 0.379 . . . . 0.0 110.051 179.458 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.584 HD11 HD13 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -71.8 -43.11 66.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.081 177.961 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 54.7 mm-40 -52.85 -38.51 61.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.732 178.624 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.69 -26.02 35.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.302 177.151 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 18.2 t60 . . . . . 0 C--N 1.331 -0.196 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.039 -179.886 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 . . . . . 0 C--O 1.232 0.166 0 CA-C-O 120.773 0.321 . . . . 0.0 110.896 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.452 HD11 ' HG2' ' A' ' 68' ' ' LYS . 0.4 OUTLIER -62.7 -80.89 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.622 179.532 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' B' B ' 7' ' ' ASN . . . . . 0.793 ' HB2' HD23 ' A' ' 47' ' ' LEU . 1.0 OUTLIER -87.02 117.43 68.62 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.831 179.193 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -73.77 6.37 2.89 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.314 2.01 . . . . 0.0 111.957 179.619 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 9' ' ' ASN . . . . . 0.515 ' HB3' ' OE1' ' A' ' 49' ' ' GLU . 71.5 m-20 -123.08 38.73 4.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.83 179.92 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . 0.622 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -59.37 88.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.961 -179.189 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.471 ' HG3' ' CD ' ' A' ' 49' ' ' GLU . 12.8 mttp -112.73 123.36 50.12 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 177.553 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -47.19 171.11 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -176.668 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 13' ' ' PHE . . . . . 0.744 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.2 OUTLIER . . . . . 0 CA--C 1.521 -0.15 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.714 179.529 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.596 ' HG2' HE22 ' A' ' 20' ' ' GLN . 33.2 mttt . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.9 0.381 . . . . 0.0 110.571 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.327 -0.374 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.047 -179.166 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.798 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 11.7 t . . . . . 0 CA--C 1.52 -0.181 0 CA-C-O 120.654 0.264 . . . . 0.0 110.339 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.68 -36.4 74.13 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 177.107 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.2 -36.26 71.84 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.785 177.341 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.798 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.4 mtm -64.45 -38.51 91.28 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.383 178.527 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.587 ' HA ' ' HE2' ' A' ' 23' ' ' MET . 50.9 mt -52.45 -49.39 64.71 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.16 179.516 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.41 -32.38 73.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.184 178.233 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.78 27.72 6.23 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.81 -178.502 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.745 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.695 -0.229 . . . . 0.0 111.202 179.696 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.745 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 2.7 tp10 . . . . . 0 N--CA 1.46 0.047 0 CA-C-O 120.611 0.243 . . . . 0.0 111.346 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.484 ' O ' HD12 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -54.41 -56.95 13.45 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.494 -178.86 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.602 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -55.94 -20.38 15.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.642 -177.963 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.451 HE21 ' HG3' ' A' ' 23' ' ' MET . 4.9 tt0 -73.0 -79.04 0.08 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.956 0.408 . . . . 0.0 111.453 179.533 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . 0.601 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.93 -94.32 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -176.684 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.601 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -61.46 3.34 0.13 Allowed 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 -174.705 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.74 -117.78 11.18 Favored Glycine 0 N--CA 1.444 -0.778 0 N-CA-C 108.214 -1.954 . . . . 0.0 108.214 -174.475 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 51' ' ' ASP . 1.3 mp0 -76.07 -67.55 0.67 Allowed 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 168.987 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.715 ' NE ' HD22 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -160.5 8.97 0.09 Allowed 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 114.258 -1.337 . . . . 0.0 108.086 176.466 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.904 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.3 OUTLIER -59.66 -73.85 0.08 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.316 -1.311 . . . . 0.0 114.051 -173.889 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.579 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -35.27 -48.45 1.15 Allowed Pre-proline 0 CA--C 1.541 0.596 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -175.42 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.599 ' HB2' ' NH1' ' A' ' 27' ' ' ARG . 45.1 Cg_exo -59.65 -41.96 51.24 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.372 2.048 . . . . 0.0 113.387 -178.601 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.946 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.33 -47.29 61.73 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 120.478 -0.489 . . . . 0.0 109.87 -178.957 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.488 HG13 ' O ' ' A' ' 28' ' ' LEU . 0.3 OUTLIER -73.3 -13.69 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.652 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.096 178.505 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.623 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 4.3 tp60 -61.33 -41.7 97.46 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 177.531 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.25 -28.8 67.53 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.124 175.13 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . 0.558 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 5.5 mtt -102.01 27.42 6.6 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.345 178.393 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.623 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -63.79 -31.59 6.62 Favored Pre-proline 0 CA--C 1.537 0.468 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -177.083 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.601 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 54.9 Cg_exo -34.63 -34.32 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.255 0 C-N-CA 122.25 1.967 . . . . 0.0 112.406 179.33 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.608 HG22 HD12 ' A' ' 76' ' ' LEU . 23.5 m -78.6 -88.08 0.06 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.79 176.638 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.436 ' CB ' ' HG ' ' A' ' 76' ' ' LEU . 0.1 OUTLIER -171.34 62.47 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.408 178.14 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.478 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -43.81 -41.14 4.84 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.653 179.586 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.579 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -50.87 -53.61 25.68 Favored Glycine 0 C--N 1.33 0.22 0 CA-C-N 116.02 -0.536 . . . . 0.0 113.807 -178.692 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.508 ' HE2' ' SD ' ' A' ' 46' ' ' MET . 0.4 OUTLIER -77.43 -39.09 48.08 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.826 0.313 . . . . 0.0 111.764 -177.969 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.621 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 31.2 mt -53.86 -56.97 6.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.5 0.19 . . . . 0.0 110.972 -179.19 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.904 ' HA ' HD22 ' A' ' 28' ' ' LEU . 10.0 t -50.76 -42.26 57.54 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.811 0.339 . . . . 0.0 110.418 178.808 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.657 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -50.62 -67.93 1.69 Allowed Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 115.953 -0.567 . . . . 0.0 112.981 -179.761 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.508 ' SD ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.29 -46.37 76.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.789 0.295 . . . . 0.0 111.664 -178.723 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.418 HD22 ' N ' ' A' ' 47' ' ' LEU . 3.2 mm? -80.18 6.52 11.52 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 111.537 0.199 . . . . 0.0 111.537 -179.166 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.657 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.1 OUTLIER -65.81 -10.74 40.46 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.064 0.459 . . . . 0.0 110.372 179.558 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.494 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.5 mm-40 -79.23 18.43 0.68 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.415 177.831 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.629 HD11 ' HE3' ' A' ' 68' ' ' LYS . 1.3 tt -83.3 160.75 3.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.175 -179.381 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.471 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 17.7 m-20 -71.15 160.29 33.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.938 -178.837 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.734 ' HA ' HD23 ' A' ' 55' ' ' LEU . 5.8 m120 -87.69 -29.61 20.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.995 177.349 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 67.9 m -72.72 -33.05 66.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.897 178.12 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.467 ' HG3' ' HB2' ' A' ' 51' ' ' ASP . 14.8 mt-10 -75.83 -28.05 58.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.612 179.041 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.734 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.4 OUTLIER -59.64 -48.81 80.18 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.303 179.597 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.481 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 1.1 tm? -61.43 -37.0 81.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.409 179.322 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.518 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 4.8 m-70 -64.52 -35.98 82.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.259 178.428 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.586 ' HB3' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -66.01 -41.94 90.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.411 178.702 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.715 HD22 ' NE ' ' A' ' 27' ' ' ARG . 3.4 tp -69.69 -14.67 62.92 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.884 179.475 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.518 ' HG2' ' O ' ' A' ' 57' ' ' HIS . 5.0 pt-20 -106.77 -3.26 20.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.818 179.282 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.572 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 4.6 m -124.39 84.74 56.29 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.968 -179.548 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -60.35 -35.03 92.8 Favored 'Trans proline' 0 N--CA 1.464 -0.255 0 C-N-CA 122.214 1.943 . . . . 0.0 112.094 179.517 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.46 ' O ' ' HB2' ' A' ' 67' ' ' SER . 0.0 OUTLIER -78.81 -44.89 22.11 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.768 -179.419 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.551 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 12.8 m -74.22 -50.44 19.11 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.827 0.346 . . . . 0.0 111.539 -177.996 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.946 HD21 HD13 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -58.16 -64.96 0.73 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.118 -179.027 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.683 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.6 OUTLIER -49.19 -33.87 13.38 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.793 0.33 . . . . 0.0 110.793 -178.801 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.595 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.6 OUTLIER -69.58 -37.03 76.8 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 121.057 0.456 . . . . 0.0 110.148 177.933 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.629 ' HE3' HD11 ' A' ' 50' ' ' ILE . 9.4 ttpt -65.76 -57.86 7.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.081 178.491 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.532 HG21 ' CD1' ' A' ' 31' ' ' LEU . 46.9 t -63.48 -19.28 23.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.781 178.925 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.667 ' O ' HG22 ' A' ' 73' ' ' VAL . 9.1 t70 -55.89 -49.59 72.99 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 176.708 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.474 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 0.7 OUTLIER -69.02 -25.74 64.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.768 176.731 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.621 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -62.15 -44.25 97.03 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.937 179.758 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.667 HG22 ' O ' ' A' ' 70' ' ' ASP . 2.5 m -61.06 -31.71 50.71 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 177.419 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.474 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -66.1 -38.5 88.38 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.039 178.946 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.587 HG22 ' O ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -58.72 -31.97 45.55 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.095 0 CA-C-O 121.001 0.429 . . . . 0.0 110.124 179.262 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.608 HD12 HG22 ' A' ' 38' ' ' THR . 2.4 tm? -70.97 -46.77 61.77 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.943 178.177 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -52.86 -37.05 59.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.405 179.212 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.21 -22.61 38.69 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.844 178.819 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 0.442 ' HB3' ' O ' ' A' ' 76' ' ' LEU . 20.4 t-80 . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.714 179.598 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.752 0.31 . . . . 0.0 110.886 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 5.7 mt -69.66 -78.59 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.683 179.706 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 7' ' ' ASN . . . . . 0.629 HD22 ' H ' ' B' ' 9' ' ' ASN . 1.0 OUTLIER -82.1 127.95 69.82 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.951 179.494 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.483 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 2.9 Cg_exo -76.96 -6.06 16.4 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.525 2.15 . . . . 0.0 111.948 179.249 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 9' ' ' ASN . . . . . 0.629 ' H ' HD22 ' B' ' 7' ' ' ASN . 14.6 m120 -123.12 56.65 1.16 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.945 179.963 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.26 96.73 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.567 179.955 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.494 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 0.7 OUTLIER -122.21 131.21 53.82 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.499 178.785 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -49.31 171.83 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.068 0.461 . . . . 0.0 112.087 -178.787 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 13' ' ' PHE . . . . . 0.465 ' CE1' ' HG ' ' A' ' 48' ' ' LEU . 0.3 OUTLIER . . . . . 0 CA--C 1.518 -0.287 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.03 179.498 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.602 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.944 0.402 . . . . 0.0 110.815 . . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.893 -179.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.21 0 N-CA-C 112.487 -0.245 . . . . 0.0 112.487 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -75.41 -20.65 15.87 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.56 2.173 . . . . 0.0 112.278 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.4 mp -86.18 45.28 1.21 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.916 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -87.42 4.18 86.15 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.36 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.548 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.1 OUTLIER -77.4 -49.95 2.18 Favored Pre-proline 0 C--N 1.329 -0.297 0 N-CA-C 111.481 0.178 . . . . 0.0 111.481 179.989 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.548 ' HD2' ' N ' ' A' ' 5' ' ' SER . 44.4 Cg_endo -68.06 -158.73 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 122.106 1.871 . . . . 0.0 112.257 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.478 ' HB3' ' OE1' ' A' ' 33' ' ' GLN . 0.4 OUTLIER -91.21 -179.42 5.42 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.009 -179.68 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.829 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 9.0 t -87.94 -29.27 20.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.355 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.42 -37.77 78.93 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 176.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 42.5 t -69.44 -35.08 75.33 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.683 177.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.829 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.2 mtm -64.41 -38.61 91.65 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.117 178.223 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.754 HD21 ' HB3' ' A' ' 24' ' ' LEU . 46.1 mt -52.42 -49.31 64.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.211 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.55 -30.53 70.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.146 178.057 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.5 p -101.44 17.92 21.46 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.763 -178.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.613 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -138.19 116.46 9.5 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.067 -179.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.425 ' HD2' ' OE2' ' A' ' 19' ' ' GLU . 53.3 Cg_exo -53.17 167.77 0.69 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.678 2.252 . . . . 0.0 112.285 179.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -56.71 -33.59 94.2 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.367 2.044 . . . . 0.0 112.423 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 12.8 mp0 -71.77 -12.32 61.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.908 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.613 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.4 OUTLIER -85.19 14.17 5.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.023 -179.891 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.698 HE22 ' HB3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -51.52 -63.56 1.1 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.13 179.76 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.617 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -55.97 -19.55 12.87 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.643 -178.239 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.551 ' N ' ' HE2' ' A' ' 21' ' ' LYS . 24.1 tt0 -73.61 -80.48 0.07 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.085 0.469 . . . . 0.0 111.465 179.039 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.681 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.8 -95.24 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.816 -176.807 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.853 HD12 ' HD3' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -60.47 -1.37 0.35 Allowed 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -175.522 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.589 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.76 -116.04 8.52 Favored Glycine 0 N--CA 1.446 -0.68 0 N-CA-C 108.423 -1.871 . . . . 0.0 108.423 -174.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.97 -69.4 0.5 Allowed 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 168.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.853 ' HD3' HD12 ' A' ' 24' ' ' LEU . 0.5 OUTLIER -160.06 9.99 0.11 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.226 -1.352 . . . . 0.0 108.002 175.007 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.998 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.41 -74.88 0.06 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.146 -1.388 . . . . 0.0 114.012 -173.456 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.6 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -34.54 -49.2 0.97 Allowed Pre-proline 0 CA--C 1.537 0.465 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -175.754 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.599 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 52.1 Cg_exo -57.68 -44.68 39.14 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.297 1.998 . . . . 0.0 113.424 -179.025 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.595 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.75 -44.07 67.54 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.178 -178.371 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.832 HD11 HD23 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -76.19 -12.72 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.13 178.021 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.633 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 3.2 tp60 -62.58 -37.41 86.09 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 176.37 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.78 -32.39 72.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.25 -0.887 . . . . 0.0 108.934 174.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.512 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 7.3 mtt -100.34 27.96 5.33 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.221 177.842 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.633 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 2.1 p-80 -63.77 -32.61 8.2 Favored Pre-proline 0 CA--C 1.536 0.442 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -177.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.544 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 62.0 Cg_exo -38.24 -28.57 0.12 Allowed 'Trans proline' 0 C--N 1.362 1.244 0 C-N-CA 122.224 1.949 . . . . 0.0 112.229 179.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.732 HG21 HG13 ' A' ' 73' ' ' VAL . 7.1 m -78.08 -86.54 0.06 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.874 176.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.497 ' O ' HG13 ' A' ' 43' ' ' ILE . 2.6 tp -171.46 49.7 0.02 OUTLIER 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.065 178.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.439 ' CA ' HG13 ' A' ' 43' ' ' ILE . . . -32.5 -46.5 0.14 Allowed 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 112.262 0.468 . . . . 0.0 112.262 -178.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.6 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -44.72 -59.12 4.45 Favored Glycine 0 C--N 1.33 0.216 0 CA-C-N 116.132 -0.485 . . . . 0.0 114.127 -178.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.739 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.5 OUTLIER -76.66 -27.08 55.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 117.032 0.416 . . . . 0.0 111.798 -177.646 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.775 HD12 HG21 ' A' ' 32' ' ' ILE . 0.9 OUTLIER -57.83 -56.34 16.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.735 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.998 ' HA ' HD22 ' A' ' 28' ' ' LEU . 12.3 t -50.54 -40.55 52.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.47 179.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.657 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -50.5 -68.41 1.46 Allowed Glycine 0 N--CA 1.451 -0.304 0 CA-C-N 115.913 -0.585 . . . . 0.0 113.28 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.655 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.61 -49.34 73.05 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 122.809 -0.23 . . . . 0.0 111.493 -178.365 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.535 HD12 ' HB2' ' B' ' 7' ' ' ASN . 2.3 mm? -79.94 9.62 5.17 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -178.366 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.627 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.96 -22.01 66.45 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.946 0.403 . . . . 0.0 110.606 179.276 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.565 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 3.4 mm-40 -74.63 21.72 0.11 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.062 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.47 ' H ' ' C ' ' A' ' 48' ' ' LEU . 2.6 tt -83.24 165.1 2.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.795 179.584 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.489 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 20.4 m-20 -70.79 156.38 39.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.862 0.363 . . . . 0.0 111.573 -179.109 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.864 ' HA ' HD23 ' A' ' 55' ' ' LEU . 5.1 m120 -88.9 -28.24 20.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.778 177.391 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.4 t -74.03 -30.18 62.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.664 177.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.489 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 4.9 mm-40 -80.11 -26.9 39.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.592 178.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.864 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.8 OUTLIER -59.16 -46.61 87.93 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.872 0.368 . . . . 0.0 110.052 179.636 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.438 HD22 ' HA ' ' A' ' 56' ' ' LEU . 0.2 OUTLIER -64.4 -41.31 96.72 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.468 179.19 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.523 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 7.0 t60 -64.5 -30.39 71.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.267 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.477 ' HB3' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -65.89 -45.24 82.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.869 -179.667 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.631 HD23 ' CG ' ' A' ' 27' ' ' ARG . 0.1 OUTLIER -66.38 -18.49 65.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.787 179.398 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.523 ' HG2' ' O ' ' A' ' 57' ' ' HIS . 4.1 pt-20 -100.14 -8.05 24.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.234 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.646 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.9 OUTLIER -125.38 88.1 54.68 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.946 179.737 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -60.06 -33.07 95.55 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.278 1.985 . . . . 0.0 112.23 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -78.0 -49.34 14.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.59 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 68.3 m -69.69 -32.24 70.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.888 0.375 . . . . 0.0 111.336 -178.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.646 ' HB3' ' O ' ' A' ' 61' ' ' SER . 1.1 tp -73.34 -65.23 0.84 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.598 -178.512 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.599 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -49.02 -29.67 5.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.186 -177.839 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.547 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.2 OUTLIER -65.43 -43.79 89.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.101 0.477 . . . . 0.0 110.286 178.292 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.452 ' HE3' HD11 ' A' ' 50' ' ' ILE . 22.1 mtpt -65.86 -55.86 14.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.626 179.208 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.507 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 53.2 t -65.01 -19.74 26.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.662 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.547 ' HB3' ' O ' ' A' ' 67' ' ' SER . 7.2 t70 -55.83 -48.52 75.3 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 176.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.48 ' O ' HG13 ' A' ' 75' ' ' VAL . 13.7 tt0 -67.06 -33.97 76.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.637 176.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.684 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -55.55 -44.73 77.06 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.651 178.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.732 HG13 HG21 ' A' ' 38' ' ' THR . 11.7 t -60.0 -32.49 50.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.936 177.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.43 -36.38 65.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.629 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.605 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.15 -28.84 35.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 120.922 0.391 . . . . 0.0 110.268 179.968 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.739 HD11 ' HB3' ' A' ' 42' ' ' LYS . 3.4 mm? -71.91 -54.32 10.39 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.802 178.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 25.5 mm100 -51.3 -36.63 43.35 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.469 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.48 -26.14 35.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.873 178.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.523 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 60.6 t60 -63.74 -45.77 88.35 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.21 -179.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -83.26 -12.76 56.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.092 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.84 -53.64 6.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.451 -179.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 23.8 mttp -77.04 -6.98 54.82 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.268 -179.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.523 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 6.5 tt0 -90.0 -39.46 12.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.113 -179.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -79.68 -27.56 40.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.2 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -84.11 30.69 0.51 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.239 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -81.1 -78.07 0.19 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.038 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -94.81 -17.13 22.39 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.985 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -87.24 53.77 2.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.166 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.0 p -103.38 117.5 48.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.939 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -104.48 -39.41 6.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.935 -179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -73.44 155.69 39.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.966 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.11 166.74 22.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.152 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 26.7 p -92.7 -178.17 4.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.837 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -77.2 149.36 35.64 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.479 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 5.4 m -91.58 148.19 36.84 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 120.547 0.213 . . . . 0.0 110.956 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -79.03 61.01 8.03 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.572 2.181 . . . . 0.0 112.44 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.2 p -87.98 107.78 18.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.951 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 5.8 t . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.075 -0.964 . . . . 0.0 111.068 -179.93 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 5.6 m . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.803 0.335 . . . . 0.0 111.041 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 3.5 t -97.8 98.0 6.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.989 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 10.6 mttm -91.69 132.06 36.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.91 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . 0.506 ' HB2' ' HB2' ' B' ' 10' ' ' ALA . 5.9 t -88.24 175.56 7.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.955 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 -113.91 -48.34 2.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.944 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.51 ' HB3' HD11 ' A' ' 47' ' ' LEU . 17.6 tp -68.94 -76.53 0.09 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.777 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . 0.682 HD22 ' H ' ' B' ' 9' ' ' ASN . 1.6 t30 -88.55 135.96 31.89 Favored Pre-proline 0 C--N 1.331 -0.197 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.856 179.38 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 5.7 Cg_exo -79.68 -3.65 13.01 Favored 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 122.73 2.287 . . . . 0.0 111.974 179.245 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' ASN . . . . . 0.682 ' H ' HD22 ' B' ' 7' ' ' ASN . 9.6 m-20 -123.16 51.09 1.48 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.174 -179.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . 0.655 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.23 93.69 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.746 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.565 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 3.0 mttp -124.94 154.08 41.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.376 178.521 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -54.51 166.12 0.48 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.808 0.337 . . . . 0.0 111.316 -179.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' PHE . . . . . 0.657 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.1 t80 -88.37 107.85 19.05 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.761 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.421 ' HA ' ' HD2' ' B' ' 15' ' ' PRO . 1.1 m -111.21 90.6 11.91 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.552 178.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' PRO . . . . . 0.421 ' HD2' ' HA ' ' B' ' 14' ' ' VAL . 15.6 Cg_endo -55.82 -167.67 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.917 2.411 . . . . 0.0 112.921 -179.284 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . 0.444 ' C ' ' HD2' ' A' ' 21' ' ' LYS . . . 85.09 -50.0 4.32 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.906 -0.664 . . . . 0.0 112.307 -179.405 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 7.1 m -116.31 151.04 18.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.69 0.281 . . . . 0.0 111.013 178.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.698 ' HB3' HE22 ' A' ' 20' ' ' GLN . 0.2 OUTLIER -70.94 89.29 0.78 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.79 179.622 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -67.4 125.1 25.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.957 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 93.35 15.93 48.81 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.549 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -100.07 166.98 10.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.806 0.336 . . . . 0.0 110.917 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 3.9 mt . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.214 -0.898 . . . . 0.0 111.091 -179.968 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.168 0 N-CA-C 112.479 -0.248 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -55.28 -39.27 91.91 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.624 2.216 . . . . 0.0 112.189 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.46 -27.33 61.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.915 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.79 96.95 2.26 Favored Glycine 0 C--N 1.33 0.224 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.489 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.599 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 0.1 OUTLIER -80.59 -50.44 1.07 Allowed Pre-proline 0 CA--C 1.534 0.332 0 N-CA-C 111.537 0.199 . . . . 0.0 111.537 -179.96 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.599 ' HD2' ' N ' ' A' ' 5' ' ' SER . 19.3 Cg_endo -58.44 110.48 0.66 Allowed 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 122.224 1.95 . . . . 0.0 112.249 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 5.6 mt -94.49 -59.76 1.87 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.83 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.851 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 9.7 t -88.0 -32.49 18.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.404 -179.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.99 -34.49 71.9 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 177.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.82 -35.72 70.01 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.608 177.151 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.851 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 3.6 mtm -64.6 -38.09 89.83 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.189 177.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.654 HD21 ' HB3' ' A' ' 24' ' ' LEU . 68.8 mt -52.69 -50.78 62.64 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.003 179.463 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.5 -26.6 67.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.715 177.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.43 18.12 20.94 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.645 -178.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.814 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -134.38 59.18 35.05 Favored Pre-proline 0 CA--C 1.532 0.283 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.994 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.494 ' HD3' ' N ' ' A' ' 15' ' ' ALA . 52.8 Cg_exo -56.39 -49.71 14.22 Favored 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 122.79 2.327 . . . . 0.0 114.058 -178.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.465 ' HD2' ' N ' ' A' ' 16' ' ' PRO . 52.7 Cg_endo -68.76 -162.08 0.08 OUTLIER 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 121.946 1.764 . . . . 0.0 112.543 -178.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -73.53 69.69 1.24 Allowed 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.62 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.814 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.9 OUTLIER -104.48 8.23 35.53 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.029 -179.242 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.576 HE22 ' HG2' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -46.86 -61.37 1.89 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.286 -178.96 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.576 ' HG2' HE22 ' A' ' 20' ' ' GLN . 0.0 OUTLIER -56.11 -25.11 44.57 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.685 -178.282 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.762 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 0.7 OUTLIER -73.26 -77.04 0.11 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.834 0.35 . . . . 0.0 111.627 179.921 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.639 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -68.99 -95.91 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -176.483 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.654 ' HB3' HD21 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -61.9 -1.8 0.73 Allowed 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -175.515 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.533 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.8 -116.64 9.21 Favored Glycine 0 N--CA 1.446 -0.688 0 N-CA-C 108.535 -1.826 . . . . 0.0 108.535 -174.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.499 ' O ' HD13 ' A' ' 55' ' ' LEU . 0.9 OUTLIER -76.13 -69.97 0.47 Allowed 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 169.052 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.772 ' HG3' HD21 ' A' ' 31' ' ' LEU . 7.4 tpt180 -159.96 13.52 0.13 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.4 -1.273 . . . . 0.0 108.044 175.566 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.495 HD12 HD11 ' A' ' 32' ' ' ILE . 4.1 mm? -57.3 -78.85 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.406 -1.27 . . . . 0.0 113.574 -173.439 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.835 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -36.05 -49.58 1.61 Allowed Pre-proline 0 CA--C 1.537 0.469 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -175.676 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.58 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 55.0 Cg_exo -55.29 -43.05 62.45 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.25 1.966 . . . . 0.0 113.611 -178.407 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.869 HD22 ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -71.18 -48.44 51.67 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.065 0.459 . . . . 0.0 110.336 -178.493 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.495 HD11 HD12 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -71.87 -14.26 17.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.091 178.672 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.631 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.3 OUTLIER -62.24 -40.77 97.29 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 176.893 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.38 -30.51 71.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.166 174.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.534 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 5.7 mtt -103.15 27.2 7.4 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.394 178.48 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.631 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 2.4 p-80 -62.92 -32.55 9.05 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -177.486 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.579 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 57.2 Cg_exo -36.0 -32.94 0.11 Allowed 'Trans proline' 0 C--N 1.362 1.266 0 C-N-CA 122.221 1.948 . . . . 0.0 112.199 179.014 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 62.6 m -78.18 -88.38 0.05 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.83 176.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.503 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.1 OUTLIER -171.31 61.06 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.513 178.324 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.481 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -47.02 -31.99 3.65 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.838 0.351 . . . . 0.0 111.508 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.643 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -43.24 -68.38 0.81 Allowed Glycine 0 CA--C 1.519 0.315 0 CA-C-N 115.697 -0.683 . . . . 0.0 114.597 -178.178 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.73 ' NZ ' ' HA ' ' B' ' 12' ' ' GLU . 0.7 OUTLIER -77.58 -29.16 51.92 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -176.809 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.649 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 37.6 mt -53.75 -52.16 37.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 121.157 -0.217 . . . . 0.0 111.378 -178.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.556 HG22 ' O ' ' A' ' 41' ' ' GLY . 5.6 t -48.17 -45.73 33.89 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.98 0.419 . . . . 0.0 110.293 178.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.714 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -52.07 -60.48 7.56 Favored Glycine 0 N--CA 1.453 -0.232 0 CA-C-N 115.623 -0.717 . . . . 0.0 113.76 -179.512 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.628 ' SD ' ' HE3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.74 -52.85 62.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.703 0.252 . . . . 0.0 111.52 -178.215 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.528 HD12 ' HB2' ' B' ' 7' ' ' ASN . 1.7 mm? -80.32 7.94 8.52 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -178.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.494 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.08 -15.15 62.83 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.922 0.391 . . . . 0.0 110.573 179.423 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.415 ' HB2' ' ND2' ' B' ' 7' ' ' ASN . 1.8 mm-40 -79.59 20.49 0.57 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.842 179.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.467 HG22 ' HG2' ' A' ' 26' ' ' GLU . 0.2 OUTLIER -83.43 161.43 3.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.745 -179.942 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.449 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 3.5 m-20 -68.27 157.06 36.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.821 -178.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.916 ' HA ' HD23 ' A' ' 55' ' ' LEU . 6.2 m120 -82.4 -31.42 29.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.149 178.037 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.477 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 1.0 OUTLIER -74.08 -30.86 62.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.348 0.594 . . . . 0.0 109.783 177.613 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.583 ' O ' ' HG2' ' A' ' 58' ' ' MET . 0.0 OUTLIER -78.77 -26.11 44.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.431 178.904 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.916 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -61.42 -49.51 76.58 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.674 -179.885 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.578 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 1.2 pp -62.81 -39.02 92.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.956 0.407 . . . . 0.0 110.69 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.646 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 13.2 t60 -62.37 -20.38 64.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.959 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.614 ' HB3' ' HG ' ' A' ' 65' ' ' LEU . 24.9 mmt -76.62 -51.58 11.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.115 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 56' ' ' LEU . 3.9 pp -64.48 -10.5 25.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.911 0.386 . . . . 0.0 110.429 179.22 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.646 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 0.0 OUTLIER -106.66 -8.22 17.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.747 179.501 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.603 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 3.3 m -122.82 79.93 49.39 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.203 -179.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -56.11 -32.75 87.94 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.161 1.907 . . . . 0.0 111.671 178.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -78.53 -51.54 9.81 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.891 -179.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.603 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 20.0 m -69.18 -52.07 31.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.951 0.405 . . . . 0.0 111.554 -177.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.869 ' HG ' HD22 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -57.81 -59.44 5.22 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.373 -178.535 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.672 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.7 OUTLIER -50.02 -33.18 17.26 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.116 -177.949 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.597 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 6.5 t -68.23 -39.1 82.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.2 0.524 . . . . 0.0 110.255 178.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.534 ' HE2' ' SD ' ' A' ' 58' ' ' MET . 1.6 ttpt -65.91 -59.12 4.16 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.434 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.497 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 42.1 t -62.57 -19.28 22.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.516 178.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.656 ' O ' HG22 ' A' ' 73' ' ' VAL . 18.5 t70 -54.88 -48.81 72.52 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 176.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.477 ' HB3' HD13 ' B' ' 6' ' ' LEU . 20.4 tt0 -68.88 -26.85 65.33 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.503 -0.772 . . . . 0.0 109.844 176.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.649 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -63.68 -47.09 82.61 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.185 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.656 HG22 ' O ' ' A' ' 70' ' ' ASP . 3.4 m -60.08 -28.87 42.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 177.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.455 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -70.39 -40.13 74.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.066 178.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.601 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -55.61 -35.45 38.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 CA-C-O 121.102 0.477 . . . . 0.0 109.811 178.862 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.436 HD13 ' C ' ' A' ' 76' ' ' LEU . 2.9 tm? -69.28 -47.28 65.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.754 177.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 20.1 mm-40 -52.07 -36.54 50.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.21 178.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.29 -27.46 35.06 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.63 178.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.423 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 79.1 t60 -64.19 -44.48 91.84 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.496 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -66.66 -19.65 65.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.819 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.1 -66.01 0.65 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.047 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 16.0 mttt -65.08 -18.45 65.32 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.088 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.423 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 1.9 tt0 -78.18 -49.31 14.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.063 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -79.51 -11.0 59.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.198 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -84.03 11.9 7.18 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.139 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -80.87 163.4 23.42 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.842 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 10.4 mttp -85.3 -176.16 6.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.009 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -83.4 7.57 16.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.09 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.4 t -77.4 140.07 17.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.021 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -85.7 86.63 7.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.814 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 66.9 m -80.06 -178.73 6.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.874 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.75 101.52 0.65 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.079 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 9.6 t -110.31 20.76 17.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.86 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -103.25 -138.04 9.72 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.574 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.2 p -84.74 132.05 47.58 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 120.621 0.248 . . . . 0.0 111.024 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -68.52 -175.67 0.95 Allowed 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.47 2.113 . . . . 0.0 112.191 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -82.88 87.86 6.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.962 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.006 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.978 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 21.6 m . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.789 0.328 . . . . 0.0 111.049 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.9 t -81.65 132.62 31.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.118 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 4.0 mmtm -86.92 109.45 19.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.904 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . 0.485 ' HB3' ' O ' ' B' ' 7' ' ' ASN . 8.9 t -85.42 176.06 8.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.896 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' ASN . . . . . 0.443 ' ND2' HG12 ' A' ' 75' ' ' VAL . 0.2 OUTLIER -108.15 -48.75 3.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.98 -179.755 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.515 HD11 ' HG3' ' A' ' 68' ' ' LYS . 5.3 tp -68.66 -74.78 0.12 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.865 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . 0.528 ' HB2' HD12 ' A' ' 47' ' ' LEU . 2.0 t30 -92.68 134.62 27.47 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.7 179.244 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -80.18 -4.17 13.04 Favored 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 122.297 1.998 . . . . 0.0 112.389 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' ASN . . . . . 0.506 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 18.0 m120 -123.28 50.9 1.51 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.852 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . 0.437 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.96 96.06 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.219 -0.446 . . . . 0.0 112.068 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.0 OUTLIER -119.07 164.71 15.11 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.685 0.279 . . . . 0.0 110.477 177.445 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . 0.73 ' HA ' ' NZ ' ' A' ' 42' ' ' LYS . 0.7 OUTLIER -62.67 161.86 11.6 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.284 -179.352 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' PHE . . . . . 0.714 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.1 t80 -88.69 102.28 14.83 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.71 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 25.7 t -109.68 94.62 17.21 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.943 178.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' PRO . . . . . 0.445 ' HB3' ' HA ' ' A' ' 22' ' ' GLN . 11.8 Cg_endo -55.34 -169.86 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 122.959 2.439 . . . . 0.0 112.99 -178.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . 0.504 ' C ' ' HD2' ' A' ' 21' ' ' LYS . . . 85.66 -42.38 3.15 Favored Glycine 0 N--CA 1.452 -0.234 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.367 -179.228 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 30.8 m -116.53 150.03 18.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.737 0.303 . . . . 0.0 111.293 178.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.574 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 0.7 OUTLIER -72.48 97.3 2.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.622 179.378 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.1 114.42 4.62 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.777 -179.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 83.96 81.67 1.01 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.38 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 25.9 p30 -96.48 172.74 7.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.765 0.317 . . . . 0.0 111.11 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 1.1 pt . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.056 179.959 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.415 ' HA2' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.489 2.195 0 N-CA-C 112.554 -0.218 . . . . 0.0 112.554 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.415 ' HD3' ' HA2' ' A' ' 1' ' ' GLY . 31.3 Cg_exo -59.46 -43.54 39.22 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.603 2.202 . . . . 0.0 112.225 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 77.3 mt -72.42 -178.73 2.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.005 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -86.9 39.71 3.09 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.753 -179.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.453 ' HA ' ' O ' ' A' ' 6' ' ' PRO . 92.1 p -76.18 158.07 82.34 Favored Pre-proline 0 C--N 1.329 -0.295 0 N-CA-C 110.767 -0.086 . . . . 0.0 110.767 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.453 ' O ' ' HA ' ' A' ' 5' ' ' SER . 8.2 Cg_exo -71.39 -159.89 1.54 Allowed 'Cis proline' 0 C--N 1.35 0.657 0 C-N-CA 124.119 -1.2 . . . . 0.0 112.615 -1.638 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.467 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.2 OUTLIER -81.26 -161.84 0.45 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.066 179.908 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.757 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 15.3 t -87.91 -32.63 18.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.626 -179.544 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.82 -33.49 70.46 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.228 0.537 . . . . 0.0 109.628 177.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 14.3 t -74.1 -35.93 64.22 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.874 177.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.757 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.6 mtm -64.37 -36.48 84.26 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.038 177.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.692 HD13 HH12 ' A' ' 27' ' ' ARG . 50.5 mt -53.02 -53.83 44.25 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.93 178.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.29 -25.14 66.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.667 177.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.9 t -101.56 24.65 9.43 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.706 -178.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.939 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -134.31 59.77 39.28 Favored Pre-proline 0 CA--C 1.533 0.302 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.915 179.462 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.486 ' HD3' ' N ' ' A' ' 15' ' ' ALA . 44.8 Cg_exo -58.0 -52.66 5.48 Favored 'Trans proline' 0 CA--C 1.538 0.709 0 C-N-CA 122.726 2.284 . . . . 0.0 113.938 -177.85 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.406 ' HD3' ' HB2' ' A' ' 16' ' ' PRO . 58.0 Cg_endo -70.31 -160.95 0.08 OUTLIER 'Trans proline' 0 C--N 1.355 0.912 0 C-N-CA 121.855 1.703 . . . . 0.0 112.308 -179.014 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -73.86 67.51 1.23 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.283 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.939 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 1.6 tp10 -104.34 6.78 35.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.985 -178.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.694 HE22 ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -47.33 -55.08 9.48 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.482 -178.725 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.694 ' HG3' HE22 ' A' ' 20' ' ' GLN . 0.0 OUTLIER -55.79 -26.4 45.89 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.779 -178.444 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.84 ' HA ' ' HB3' ' B' ' 15' ' ' PRO . 0.6 OUTLIER -72.47 -76.75 0.11 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.765 0.317 . . . . 0.0 111.643 -179.44 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.556 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.16 -96.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -176.841 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.556 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -62.07 -1.95 0.81 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 113.596 0.962 . . . . 0.0 113.596 -175.219 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.43 ' HA3' HD11 ' A' ' 48' ' ' LEU . . . 65.05 -115.75 8.12 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 108.497 -1.841 . . . . 0.0 108.497 -174.062 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.454 ' O ' HD13 ' A' ' 24' ' ' LEU . 0.5 OUTLIER -75.98 -69.9 0.47 Allowed 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 168.995 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.757 ' HG3' HD21 ' A' ' 31' ' ' LEU . 9.5 tpt180 -159.7 13.22 0.14 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 114.282 -1.326 . . . . 0.0 108.029 175.256 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.634 HD12 HD11 ' A' ' 32' ' ' ILE . 3.9 mm? -57.32 -76.46 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.513 -1.221 . . . . 0.0 113.506 -174.218 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.639 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -37.25 -49.87 2.36 Favored Pre-proline 0 CA--C 1.535 0.381 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -175.122 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.556 ' HG2' ' HD2' ' A' ' 27' ' ' ARG . 50.0 Cg_exo -56.71 -43.64 52.86 Favored 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 122.249 1.966 . . . . 0.0 113.64 -177.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.781 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.66 -47.39 60.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.141 0.496 . . . . 0.0 110.185 -178.432 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.753 HG21 HD12 ' A' ' 43' ' ' ILE . 0.5 OUTLIER -75.36 -13.16 15.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.499 178.845 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.658 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 8.7 tp-100 -62.59 -39.55 94.07 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 177.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.55 -31.93 72.95 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.266 -0.879 . . . . 0.0 108.814 174.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.492 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 6.2 mtt -100.73 27.2 6.08 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.409 177.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.658 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.9 p-80 -64.06 -33.19 8.92 Favored Pre-proline 0 CA--C 1.535 0.399 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 -177.097 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.546 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 53.2 Cg_exo -37.11 -30.39 0.11 Allowed 'Trans proline' 0 C--N 1.361 1.187 0 C-N-CA 122.286 1.991 . . . . 0.0 112.36 179.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.912 HG21 HG13 ' A' ' 73' ' ' VAL . 90.2 m -78.28 -85.17 0.07 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.238 177.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.533 ' O ' HG13 ' A' ' 43' ' ' ILE . 7.9 tp -171.11 51.29 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.21 178.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.456 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -39.83 -38.18 0.64 Allowed 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.852 -179.547 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.639 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.08 -55.72 9.87 Favored Glycine 0 C--N 1.331 0.289 0 CA-C-N 116.096 -0.502 . . . . 0.0 114.012 -179.174 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.899 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -78.27 -34.27 49.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 117.098 0.449 . . . . 0.0 111.817 -178.654 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.753 HD12 HG21 ' A' ' 32' ' ' ILE . 0.9 OUTLIER -54.11 -55.84 12.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.613 0.245 . . . . 0.0 111.238 -179.083 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.559 HG21 ' CD2' ' A' ' 29' ' ' PHE . 5.2 t -47.22 -49.17 23.67 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.477 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.575 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -50.23 -51.44 30.98 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 121.092 -0.575 . . . . 0.0 112.901 179.149 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.516 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 3.1 mmm -55.72 -68.05 0.23 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.332 0.587 . . . . 0.0 111.364 -179.404 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.74 HD11 ' HB2' ' B' ' 6' ' ' LEU . 4.0 mm? -74.15 10.62 1.16 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.184 -0.917 . . . . 0.0 111.701 -177.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.522 ' HB3' ' HD2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -66.17 -24.39 66.64 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.972 0.415 . . . . 0.0 110.302 178.835 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.479 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 3.0 mt-10 -74.59 22.38 0.1 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.967 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.628 HD11 ' HE3' ' A' ' 68' ' ' LYS . 2.6 tt -83.63 166.87 2.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.76 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.447 ' HB2' ' HG3' ' A' ' 54' ' ' GLU . 7.6 m-20 -70.82 155.29 40.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.419 -179.422 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.882 ' HA ' HD23 ' A' ' 55' ' ' LEU . 4.8 m120 -83.21 -29.62 28.38 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.064 178.062 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.06 -31.88 63.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.747 177.547 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.447 ' HG3' ' HB2' ' A' ' 51' ' ' ASP . 6.1 mt-10 -79.46 -27.17 41.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.699 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.882 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -59.47 -46.73 87.97 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.084 0.469 . . . . 0.0 109.925 179.123 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.496 ' O ' ' HG3' ' A' ' 60' ' ' GLU . 1.0 OUTLIER -61.2 -44.93 96.49 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.653 179.403 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 25.7 t60 -57.08 -40.33 76.7 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.055 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.527 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -58.91 -42.39 89.51 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.645 179.184 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.653 HD12 ' NE ' ' A' ' 27' ' ' ARG . 9.0 tt -63.8 -24.53 67.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.063 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.496 ' HG3' ' O ' ' A' ' 56' ' ' LEU . 17.4 mt-10 -105.3 2.89 29.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.338 -178.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.565 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 43.6 m -122.66 78.24 47.66 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.675 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.458 ' O ' ' HB2' ' A' ' 66' ' ' ARG . 18.7 Cg_endo -57.84 -34.94 98.94 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.339 2.026 . . . . 0.0 112.099 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -78.39 -46.96 18.63 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.728 -179.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.524 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 12.8 m -72.91 -53.39 11.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.648 -177.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.781 HD21 HD13 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -57.82 -58.9 6.34 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.264 -178.387 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.686 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -50.94 -36.24 37.61 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.859 -0.337 . . . . 0.0 111.102 -178.246 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.4 m -69.39 -36.25 76.58 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.071 0.462 . . . . 0.0 110.292 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.628 ' HE3' HD11 ' A' ' 50' ' ' ILE . 5.5 ttpt -65.77 -56.26 12.89 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.263 178.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.52 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 30.2 t -64.85 -21.23 28.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.36 178.537 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.428 ' HB2' ' O ' ' A' ' 66' ' ' ARG . 13.7 t70 -53.45 -48.03 69.18 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 177.295 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.419 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 0.4 OUTLIER -68.83 -32.92 72.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.767 176.836 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.646 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -55.69 -42.44 75.2 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.163 177.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.912 HG13 HG21 ' A' ' 38' ' ' THR . 24.4 t -60.82 -31.65 50.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 176.647 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.419 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -73.46 -36.41 65.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.604 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.569 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -57.73 -28.22 31.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.895 0.379 . . . . 0.0 110.092 179.79 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.899 HD11 ' HB3' ' A' ' 42' ' ' LYS . 3.0 mm? -71.62 -54.31 10.83 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.534 178.358 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -51.12 -34.63 31.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.439 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.491 ' O ' ' HB2' ' A' ' 82' ' ' LYS . . . -81.5 -30.91 33.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.828 178.479 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 12.5 t-160 -64.58 -30.68 71.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.083 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -83.93 -40.51 18.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.759 -179.346 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -78.78 -54.8 5.71 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -177.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 78' ' ' ALA . 8.0 mmtt -59.46 -31.3 69.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.697 -178.07 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -81.27 -46.16 15.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.979 -179.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.537 ' HA ' ' HG3' ' A' ' 87' ' ' LYS . . . -80.16 8.29 7.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.117 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -73.06 -50.01 25.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.062 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -76.43 -15.16 59.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.957 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.537 ' HG3' ' HA ' ' A' ' 84' ' ' ALA . 0.1 OUTLIER -83.31 -167.76 1.82 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.988 179.931 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.91 83.64 0.94 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.161 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.66 HG22 ' H ' ' A' ' 91' ' ' SER . 13.8 p -83.35 144.77 9.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.012 179.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -84.06 11.4 8.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.132 -179.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.66 ' H ' HG22 ' A' ' 89' ' ' VAL . 7.9 t -83.93 135.96 34.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.015 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.91 109.61 12.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.966 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.81 144.95 32.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.003 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.487 ' O ' ' HD3' ' A' ' 96' ' ' PRO . . . -91.44 -59.67 1.35 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.484 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 1.1 m -108.02 94.15 12.27 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.649 0.262 . . . . 0.0 111.141 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.487 ' HD3' ' O ' ' A' ' 94' ' ' GLY . 37.2 Cg_exo -57.81 120.51 8.47 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.558 2.172 . . . . 0.0 112.256 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 81.5 p -84.65 1.9 44.11 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.865 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.931 -179.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 7.2 p . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.722 0.296 . . . . 0.0 111.092 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 5.6 m -80.86 135.93 24.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.899 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . 0.411 ' HE3' ' N ' ' B' ' 3' ' ' LYS . 0.0 OUTLIER -94.24 81.99 4.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.966 -179.797 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.67 161.62 16.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.653 179.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -104.32 -66.7 0.94 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.078 -179.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.74 ' HB2' HD11 ' A' ' 47' ' ' LEU . 16.6 mt -64.85 -87.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.774 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . 0.685 HD22 ' H ' ' B' ' 9' ' ' ASN . 0.5 OUTLIER -74.46 124.97 90.19 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.708 179.212 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -79.07 3.82 7.08 Favored 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.18 1.92 . . . . 0.0 112.111 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' ASN . . . . . 0.685 ' H ' HD22 ' B' ' 7' ' ' ASN . 32.8 m-80 -123.53 44.5 2.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.902 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . 0.516 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.57 98.13 0.06 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.494 179.552 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.507 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.1 OUTLIER -122.24 -179.51 4.2 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.634 178.848 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -68.46 172.29 6.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.82 179.055 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' PHE . . . . . 0.575 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.1 t80 -101.03 107.33 18.75 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.974 0.416 . . . . 0.0 110.93 179.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 1.1 m -111.6 92.07 15.99 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.384 178.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' PRO . . . . . 0.84 ' HB3' ' HA ' ' A' ' 22' ' ' GLN . 53.1 Cg_exo -55.42 -172.83 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.735 2.29 . . . . 0.0 112.775 -178.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . 0.441 ' O ' ' HE3' ' A' ' 21' ' ' LYS . . . 85.0 -43.16 3.22 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.412 -179.514 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -115.77 142.31 29.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.745 0.307 . . . . 0.0 110.931 179.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.67 ' HG2' HE22 ' A' ' 20' ' ' GLN . 9.1 mttt -67.19 98.99 0.64 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.788 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.522 ' HD2' ' HB3' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -73.36 118.68 16.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.902 179.906 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 87.62 28.35 24.51 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.518 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 24.0 t30 -89.24 69.85 8.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.792 0.329 . . . . 0.0 110.849 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 2.8 tp . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.286 -0.864 . . . . 0.0 111.127 -179.877 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.112 0 CA-C-O 120.143 -0.254 . . . . 0.0 112.561 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -77.03 -175.61 2.75 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.588 2.192 . . . . 0.0 112.253 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -91.77 81.2 5.23 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.877 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -101.43 94.42 1.24 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.484 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.0 t -95.06 132.85 27.26 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 120.648 0.261 . . . . 0.0 110.838 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.05 -154.95 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.549 2.166 . . . . 0.0 112.224 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.513 HD12 ' HB2' ' A' ' 10' ' ' SER . 0.0 OUTLIER -92.67 -173.62 3.4 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.662 179.647 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.792 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 3.6 t -87.93 -31.31 19.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.273 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.37 -35.43 73.9 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 176.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.513 ' HB2' HD12 ' A' ' 7' ' ' LEU . 1.7 t -71.08 -36.19 72.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.623 177.116 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.792 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.3 mtm -64.23 -34.4 78.01 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.896 177.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.686 HD12 ' SD ' ' A' ' 23' ' ' MET . 1.2 mp -52.74 -52.61 55.68 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.843 178.351 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.02 -26.99 67.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.915 178.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.406 ' C ' ' HD3' ' A' ' 16' ' ' PRO . 4.7 p -101.5 21.23 14.61 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.74 -178.795 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.902 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -134.09 55.92 17.14 Favored Pre-proline 0 CA--C 1.534 0.358 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.208 179.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.551 ' HD3' ' N ' ' A' ' 15' ' ' ALA . 52.2 Cg_exo -57.81 -49.67 12.47 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 122.658 2.239 . . . . 0.0 114.095 -178.341 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.448 ' HD2' ' N ' ' A' ' 16' ' ' PRO . 53.1 Cg_endo -69.11 -157.34 0.04 OUTLIER 'Trans proline' 0 C--N 1.355 0.913 0 C-N-CA 121.928 1.752 . . . . 0.0 112.765 -178.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -74.64 47.44 0.32 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.401 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.902 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 1.7 tp10 -86.05 15.7 4.84 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.373 179.53 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.496 HE22 ' HG2' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -51.53 -68.29 0.18 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.628 -179.082 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.561 ' HE2' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.4 -18.49 6.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.371 -178.066 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.648 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 5.4 tp60 -73.6 -79.82 0.08 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.901 0.381 . . . . 0.0 111.336 178.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.686 ' SD ' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.57 -96.09 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 N-CA-C 112.616 0.599 . . . . 0.0 112.616 -177.08 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.628 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -61.04 0.43 0.23 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.059 0.762 . . . . 0.0 113.059 -176.064 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.584 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.4 -118.12 12.1 Favored Glycine 0 N--CA 1.446 -0.655 0 N-CA-C 108.332 -1.907 . . . . 0.0 108.332 -175.011 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.444 ' O ' HD13 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -75.98 -67.65 0.66 Allowed 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 168.71 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.631 ' HB2' HD13 ' A' ' 55' ' ' LEU . 5.2 tpt180 -160.16 12.0 0.12 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.385 -1.28 . . . . 0.0 108.442 175.373 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.621 HD12 HD11 ' A' ' 32' ' ' ILE . 4.2 mm? -57.82 -80.44 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.846 -1.07 . . . . 0.0 113.713 -174.16 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.675 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -33.46 -50.16 0.74 Allowed Pre-proline 0 CA--C 1.537 0.446 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -175.223 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.603 ' HG2' ' O ' ' A' ' 27' ' ' ARG . 12.7 Cg_endo -59.16 -42.15 53.4 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.204 1.936 . . . . 0.0 113.521 -177.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.624 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.09 -45.76 63.08 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 120.144 -0.622 . . . . 0.0 110.151 -179.147 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.621 HD11 HD12 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -74.7 -12.36 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.998 178.142 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.642 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 60.3 tp60 -62.13 -39.29 92.08 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 176.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.0 -31.66 71.52 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.298 -0.864 . . . . 0.0 109.076 174.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.521 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 7.1 mtt -100.54 28.13 5.31 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.225 178.014 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.642 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.2 OUTLIER -64.09 -31.95 6.88 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 -177.267 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.543 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 63.0 Cg_exo -37.68 -30.51 0.14 Allowed 'Trans proline' 0 C--N 1.361 1.236 0 C-N-CA 122.047 1.831 . . . . 0.0 112.159 179.055 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.906 HG21 HG13 ' A' ' 73' ' ' VAL . 0.2 OUTLIER -78.16 -89.11 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.737 176.578 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.53 ' H ' ' HB ' ' A' ' 38' ' ' THR . 0.1 OUTLIER -171.24 58.4 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.92 177.718 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.49 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -43.47 -35.4 1.61 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.743 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.661 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.16 -57.42 8.02 Favored Glycine 0 C--O 1.229 -0.216 0 CA-C-N 115.961 -0.563 . . . . 0.0 114.098 -178.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.537 ' HE3' ' HA ' ' B' ' 12' ' ' GLU . 1.6 tptm -79.03 -39.01 35.11 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 117.085 0.442 . . . . 0.0 112.15 -178.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.697 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 17.2 mt -53.09 -48.62 53.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 C-N-CA 121.155 -0.218 . . . . 0.0 111.426 -177.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.527 HG21 ' CD2' ' A' ' 29' ' ' PHE . 5.1 t -47.86 -48.04 31.33 Favored 'General case' 0 CA--C 1.521 -0.17 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 178.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.565 ' CA ' ' HB2' ' B' ' 13' ' ' PHE . . . -56.67 -53.25 45.17 Favored Glycine 0 N--CA 1.449 -0.458 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.871 179.212 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.921 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.33 -56.43 20.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.794 0.33 . . . . 0.0 110.982 -179.112 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.623 HD22 ' HB2' ' A' ' 46' ' ' MET . 2.9 mm? -80.28 7.76 8.83 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.397 -179.247 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.484 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.46 -20.9 66.55 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.791 0.329 . . . . 0.0 110.748 179.897 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.48 ' HG3' ' O ' ' B' ' 9' ' ' ASN . 3.6 mt-10 -75.71 20.27 0.18 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.888 179.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.64 HD11 ' HE3' ' A' ' 68' ' ' LYS . 2.7 tt -83.58 169.07 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.905 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.44 ' HB2' ' HG3' ' A' ' 54' ' ' GLU . 2.6 m-20 -71.03 155.93 40.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.951 0.405 . . . . 0.0 111.427 -179.626 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.809 ' HA ' HD23 ' A' ' 55' ' ' LEU . 4.2 m120 -88.06 -28.46 21.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.643 177.238 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.96 -30.67 62.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.608 177.125 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.578 ' O ' ' HG2' ' A' ' 58' ' ' MET . 4.0 mt-10 -77.26 -29.41 53.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.49 178.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.809 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -58.79 -46.1 88.36 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.209 -179.901 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.428 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 7.6 tp -60.75 -47.38 86.56 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.558 178.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -65.72 -20.07 66.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.375 -179.644 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.631 ' SD ' ' HA ' ' A' ' 65' ' ' LEU . 25.3 mmt -69.65 -54.57 13.28 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.054 -179.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.54 HD23 ' CG ' ' A' ' 27' ' ' ARG . 0.1 OUTLIER -63.27 -17.87 62.96 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.893 0.377 . . . . 0.0 110.685 179.479 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.478 ' O ' ' HG3' ' A' ' 60' ' ' GLU . 0.0 OUTLIER -94.73 -13.26 25.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.788 -179.856 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.595 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.5 OUTLIER -122.3 87.66 48.44 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.189 -179.872 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -59.31 -32.22 96.41 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.268 1.979 . . . . 0.0 112.129 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -77.78 -49.77 13.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.618 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.421 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 75.5 m -69.16 -46.34 67.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.185 -178.469 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.631 ' HA ' ' SD ' ' A' ' 58' ' ' MET . 1.2 tp -60.17 -64.74 0.84 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.814 -178.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.57 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -49.54 -28.83 5.98 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.875 -177.933 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.482 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 9.2 t -62.32 -45.32 93.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.181 177.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.64 ' HE3' HD11 ' A' ' 50' ' ' ILE . 14.2 mtmm -66.45 -62.05 1.67 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.921 179.355 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.471 ' HA ' ' HB3' ' A' ' 72' ' ' ALA . 73.2 t -57.75 -20.72 14.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.756 -179.321 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.482 ' HB3' ' O ' ' A' ' 67' ' ' SER . 10.0 t70 -57.26 -49.22 76.74 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 175.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.468 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 5.7 tt0 -67.18 -27.76 67.54 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.547 175.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.697 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -66.1 -36.68 83.83 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.586 178.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.906 HG13 HG21 ' A' ' 38' ' ' THR . 5.1 t -59.94 -32.85 50.94 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.184 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 176.23 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -73.69 -34.18 64.76 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.824 175.379 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.594 ' HB ' ' O ' ' A' ' 72' ' ' ALA . 15.7 t -55.03 -33.07 28.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.919 178.205 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.634 ' HB2' HG12 ' A' ' 43' ' ' ILE . 3.1 tm? -71.36 -47.08 58.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.173 177.581 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 32.6 mm-40 -63.87 -24.05 67.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.048 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.8 -24.94 38.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.834 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.576 ' O ' ' HB3' ' A' ' 83' ' ' GLU . 26.1 t-80 -68.48 -41.68 79.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.861 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 66.3 mt-30 -62.86 -14.9 51.71 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.267 -179.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -76.55 -54.55 6.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.138 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.03 -19.51 47.49 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.115 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.576 ' HB3' ' O ' ' A' ' 79' ' ' HIS . 0.2 OUTLIER -75.36 -47.17 28.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.674 179.986 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.412 ' N ' ' HG3' ' A' ' 83' ' ' GLU . . . -65.6 -13.63 59.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.057 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -74.63 -14.61 60.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.98 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -77.34 -55.69 5.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.808 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.15 -72.23 0.43 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.858 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -74.56 93.16 2.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.086 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 4.6 t -92.75 102.47 13.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.047 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.15 76.07 1.7 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.838 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.01 179.86 7.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.966 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.02 90.65 4.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.982 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 19.1 p -97.55 -178.81 4.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.906 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -83.82 81.28 1.76 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.467 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 1.9 t -104.8 113.34 64.99 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 120.632 0.254 . . . . 0.0 111.125 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -60.04 167.87 6.75 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.715 2.277 . . . . 0.0 112.206 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 14.1 p -91.14 145.92 24.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.858 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 1.4 t . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.036 -0.983 . . . . 0.0 111.084 -179.796 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 8.3 p . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 121.217 0.532 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 5.9 p -84.17 134.21 27.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.13 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.31 172.2 8.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.053 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . 0.409 ' HB2' ' HB3' ' B' ' 10' ' ' ALA . 4.5 t -83.26 -150.02 0.1 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.601 179.483 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -103.89 -62.13 1.35 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.65 0.262 . . . . 0.0 110.943 -179.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.582 ' HB3' HD11 ' A' ' 47' ' ' LEU . 27.1 tp -71.92 -83.68 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.381 179.318 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . 0.495 HD22 ' H ' ' B' ' 9' ' ' ASN . 1.9 t30 -82.81 129.15 63.08 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.267 178.151 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 7.1 Cg_exo -73.94 4.25 4.35 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.187 1.924 . . . . 0.0 111.997 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' ASN . . . . . 0.495 ' H ' HD22 ' B' ' 7' ' ' ASN . 18.5 m120 -123.63 37.42 4.42 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.308 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . 0.921 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.43 87.5 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.087 179.263 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.45 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 1.5 mmtp -116.21 177.86 4.53 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.964 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . 0.537 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -68.21 158.76 32.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.72 0.295 . . . . 0.0 111.065 179.76 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' PHE . . . . . 0.565 ' HB2' ' CA ' ' A' ' 45' ' ' GLY . 1.1 t80 -88.86 110.27 20.92 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.857 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 1.2 m -111.58 87.64 8.29 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.342 178.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' PRO . . . . . 0.488 ' HD3' ' O ' ' B' ' 13' ' ' PHE . 52.0 Cg_exo -55.72 -166.17 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 122.889 2.393 . . . . 0.0 113.139 -178.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.3 -50.86 4.43 Favored Glycine 0 N--CA 1.452 -0.239 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.386 -179.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 10.9 m -116.69 161.8 15.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.728 0.299 . . . . 0.0 111.027 178.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.496 ' HG2' HE22 ' A' ' 20' ' ' GLN . 0.0 OUTLIER -75.95 96.6 3.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.672 179.356 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -65.0 99.28 0.34 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.943 -179.664 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 78.66 71.6 1.23 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.424 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 14.2 p-10 -101.42 131.4 47.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.744 0.307 . . . . 0.0 110.888 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 23.1 mm . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.189 -0.91 . . . . 0.0 111.065 -179.847 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.19 0 N-CA-C 112.45 -0.26 . . . . 0.0 112.45 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -57.23 165.99 4.86 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.622 2.215 . . . . 0.0 112.277 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.23 89.29 7.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.79 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -98.03 -27.92 8.54 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.595 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 16.8 t -88.89 110.97 41.68 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 120.549 0.214 . . . . 0.0 110.902 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -68.09 153.61 74.5 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.478 2.119 . . . . 0.0 112.312 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.428 ' O ' ' HG3' ' A' ' 11' ' ' MET . 6.7 mp -86.55 -174.99 5.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.87 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.815 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 12.7 t -87.93 -26.17 22.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.236 179.679 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.61 -41.01 89.41 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 176.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 7.5 t -67.44 -33.79 75.88 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.508 176.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.815 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.1 mtm -64.25 -37.24 86.79 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.182 177.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.842 HD21 ' HB3' ' A' ' 24' ' ' LEU . 22.9 mt -54.28 -45.99 72.62 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.547 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.8 -36.3 82.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.102 178.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -101.16 46.55 0.94 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.047 -179.655 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.794 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -133.06 -41.33 0.03 OUTLIER Pre-proline 0 CA--C 1.536 0.437 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 -178.076 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.744 ' HD2' ' H ' ' A' ' 15' ' ' ALA . 70.4 Cg_exo -46.52 154.63 0.9 Allowed 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 121.866 1.71 . . . . 0.0 112.893 -176.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.725 ' O ' ' HA ' ' A' ' 16' ' ' PRO . 14.4 Cg_exo -71.75 -99.45 0.0 OUTLIER 'Cis proline' 0 CA--C 1.539 0.737 0 C-N-CA 124.251 -1.146 . . . . 0.0 114.414 3.225 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.507 ' H ' ' HB2' ' A' ' 17' ' ' PRO . 17.9 mt-30 -74.82 65.68 1.41 Allowed 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 113.307 0.854 . . . . 0.0 113.307 -175.438 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.794 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 1.1 tp10 -105.63 12.94 30.57 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.64 0.257 . . . . 0.0 110.876 176.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.673 HE22 ' HG2' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -47.0 -56.7 5.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.605 -178.853 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.621 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -56.07 -22.34 27.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.648 -178.359 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.621 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 5.4 tp60 -73.46 -79.91 0.08 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.915 0.388 . . . . 0.0 111.677 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.742 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.76 -96.22 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -176.47 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.842 ' HB3' HD21 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -59.26 -2.45 0.29 Allowed 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 113.647 0.98 . . . . 0.0 113.647 -175.359 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.636 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.48 -116.78 9.45 Favored Glycine 0 N--CA 1.448 -0.549 0 N-CA-C 108.374 -1.891 . . . . 0.0 108.374 -174.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.446 ' HG2' ' O ' ' A' ' 51' ' ' ASP . 0.8 OUTLIER -76.23 -69.14 0.52 Allowed 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 168.269 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.766 ' NE ' HD13 ' A' ' 59' ' ' LEU . 0.2 OUTLIER -159.82 13.1 0.13 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.163 -1.381 . . . . 0.0 108.178 174.56 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.546 ' O ' HG13 ' A' ' 32' ' ' ILE . 4.1 mm? -57.64 -78.57 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.662 -1.153 . . . . 0.0 113.439 -174.379 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.617 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -37.42 -48.88 2.47 Favored Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 -174.799 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.59 ' HG3' ' HB2' ' A' ' 24' ' ' LEU . 12.6 Cg_endo -58.69 -43.29 45.82 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 122.14 1.893 . . . . 0.0 113.621 -177.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.19 -46.69 60.74 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 120.111 -0.636 . . . . 0.0 110.289 -178.719 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.546 HG13 ' O ' ' A' ' 28' ' ' LEU . 0.4 OUTLIER -73.28 -12.47 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 CA-C-N 116.208 -0.451 . . . . 0.0 109.969 178.224 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.608 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 47.7 tp60 -62.14 -40.54 96.3 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 176.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.62 -29.98 69.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.08 174.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.536 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 6.7 mtt -101.65 27.17 6.61 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.394 178.428 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.608 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -63.66 -32.08 7.49 Favored Pre-proline 0 CA--C 1.537 0.445 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -177.594 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.572 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 50.5 Cg_exo -35.97 -32.55 0.1 Allowed 'Trans proline' 0 C--N 1.363 1.342 0 C-N-CA 122.178 1.919 . . . . 0.0 112.034 178.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.837 HG21 HG13 ' A' ' 73' ' ' VAL . 7.2 m -78.14 -88.58 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.512 176.014 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.509 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.3 OUTLIER -171.59 62.73 0.03 OUTLIER 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.196 177.552 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.516 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -46.67 -34.72 5.32 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.662 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.617 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -52.88 -53.94 30.93 Favored Glycine 0 C--N 1.33 0.239 0 C-N-CA 121.17 -0.538 . . . . 0.0 113.81 -178.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.501 ' HD2' ' HG2' ' B' ' 12' ' ' GLU . 0.0 OUTLIER -78.11 -39.0 42.7 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.887 0.343 . . . . 0.0 111.797 -178.387 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.692 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 31.8 mt -53.95 -54.14 22.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.038 -179.385 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.583 HG21 ' CD2' ' A' ' 29' ' ' PHE . 6.4 t -50.17 -45.69 53.58 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 120.889 0.376 . . . . 0.0 110.121 178.003 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.565 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -50.83 -67.46 1.92 Allowed Glycine 0 N--CA 1.451 -0.317 0 CA-C-N 115.606 -0.724 . . . . 0.0 113.235 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.462 ' H ' ' HG2' ' A' ' 46' ' ' MET . 0.0 OUTLIER -56.05 -46.06 79.05 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 -178.031 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.44 HD22 ' N ' ' A' ' 47' ' ' LEU . 3.3 mm? -80.11 3.09 21.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.719 -0.219 . . . . 0.0 111.588 -178.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.565 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.96 -8.24 21.51 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.938 0.399 . . . . 0.0 110.54 179.253 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.449 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 1.4 mm-40 -83.47 18.36 1.87 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.373 178.433 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.405 HG23 ' O ' ' A' ' 51' ' ' ASP . 1.5 tt -83.27 163.85 2.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.96 -179.272 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.446 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 3.4 m-20 -70.81 157.56 37.88 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.564 -179.124 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.83 ' HA ' HD23 ' A' ' 55' ' ' LEU . 4.6 m120 -86.61 -28.83 23.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.969 177.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 8.7 m -73.9 -32.09 63.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.644 177.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -75.98 -29.5 58.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.554 178.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.83 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.5 OUTLIER -59.45 -47.74 84.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.504 -179.766 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.462 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 52.4 tp -61.7 -40.72 96.02 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.712 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -66.02 -30.95 71.58 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.164 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.48 -54.85 22.38 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.897 -179.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.766 HD13 ' NE ' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -66.1 -13.08 59.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.115 0.483 . . . . 0.0 110.123 178.76 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.506 ' HG3' ' O ' ' A' ' 60' ' ' GLU . 2.3 tp10 -95.46 -12.92 25.07 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.631 177.537 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.547 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 4.1 m -122.57 79.58 47.21 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.732 179.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -54.58 -34.21 81.87 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.398 2.065 . . . . 0.0 112.206 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -77.95 -49.72 13.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.552 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.445 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 3.7 m -71.23 -23.12 61.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.904 0.383 . . . . 0.0 111.4 -178.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.549 ' HG ' ' N ' ' A' ' 66' ' ' ARG . 1.7 tp -78.54 -64.87 1.07 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.639 -178.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.549 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 1.5 ttm180 -51.43 -29.27 15.41 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.849 -178.104 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.56 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 3.3 t -69.67 -40.84 76.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.301 0.572 . . . . 0.0 110.005 177.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.628 ' O ' HD11 ' B' ' 6' ' ' LEU . 21.4 ttpt -65.74 -59.69 3.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.203 178.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.506 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 54.1 t -62.47 -19.89 23.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.637 179.222 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.56 ' HB3' ' O ' ' A' ' 67' ' ' SER . 17.1 t70 -54.07 -48.99 70.05 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 176.531 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -66.77 -32.9 74.5 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.658 176.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.692 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -58.19 -38.11 76.09 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.525 178.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.837 HG13 HG21 ' A' ' 38' ' ' THR . 8.0 t -65.26 -31.4 53.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.61 177.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.1 -37.08 69.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.146 179.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.66 HG12 ' HB2' ' B' ' 5' ' ' ASN . 0.9 OUTLIER -57.61 -31.71 40.2 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.115 0 CA-C-O 121.168 0.508 . . . . 0.0 109.955 178.989 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.64 HD12 HG22 ' A' ' 38' ' ' THR . 2.8 tm? -71.24 -49.91 38.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.39 179.061 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -54.94 -37.33 66.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.664 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.15 -24.28 37.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.811 179.133 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.486 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 6.6 t60 -66.1 -53.84 33.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.816 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -66.13 -15.37 63.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.042 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -63.5 -66.59 0.52 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.912 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.68 -11.9 60.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.775 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.486 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 0.2 OUTLIER -83.66 -25.63 30.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.846 179.757 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.22 -24.94 67.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.04 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.41 -46.99 80.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.987 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 4.9 mm100 -81.41 -161.68 0.44 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.811 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.94 101.4 5.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.823 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -84.03 65.49 8.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.926 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -97.44 173.43 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.03 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -91.66 -57.35 2.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.958 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.46 109.1 12.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.955 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -87.93 -63.56 1.28 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.055 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 22.4 p -111.18 -177.64 3.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.888 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -101.71 89.66 0.78 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.524 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.0 m -95.81 141.44 23.18 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 120.633 0.254 . . . . 0.0 111.051 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -58.29 -71.24 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.618 2.212 . . . . 0.0 112.409 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.4 m -107.11 -65.03 1.13 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.97 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 16.7 m . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.071 -0.966 . . . . 0.0 111.03 -179.959 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 1.5 t . . . . . 0 N--CA 1.487 1.417 0 CA-C-O 120.886 0.374 . . . . 0.0 110.859 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 19.2 t -81.39 138.69 19.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.999 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 4.9 mtpm? -91.84 85.32 5.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.061 -179.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.36 179.79 5.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.769 179.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' ASN . . . . . 0.66 ' HB2' HG12 ' A' ' 75' ' ' VAL . 0.4 OUTLIER -104.01 -77.12 0.58 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.881 -179.549 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.628 HD11 ' O ' ' A' ' 68' ' ' LYS . 5.6 mt -62.81 -85.32 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.808 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . 0.448 ' HA ' ' HD3' ' B' ' 8' ' ' PRO . 2.7 t30 -75.85 130.05 79.63 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.866 179.538 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 6.6 Cg_exo -73.28 -3.41 13.63 Favored 'Trans proline' 0 N--CA 1.46 -0.475 0 C-N-CA 122.368 2.045 . . . . 0.0 111.625 178.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' ASN . . . . . 0.409 ' HB3' ' NZ ' ' B' ' 11' ' ' LYS . 7.9 m120 -123.48 51.97 1.45 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.636 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.86 95.67 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.756 -179.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.449 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 9.6 mttp -121.57 121.69 37.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.027 178.072 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . 0.501 ' HG2' ' HD2' ' A' ' 42' ' ' LYS . 6.0 mt-10 -49.68 176.87 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.315 0.579 . . . . 0.0 112.366 -177.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' PHE . . . . . 0.552 ' CE1' ' HG ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -87.24 97.08 10.57 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.248 179.952 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.616 ' HB ' ' HD3' ' B' ' 15' ' ' PRO . 2.8 t -129.29 -53.98 0.03 OUTLIER Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.489 -178.082 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' PRO . . . . . 0.616 ' HD3' ' HB ' ' B' ' 14' ' ' VAL . 85.9 Cg_exo -47.73 -36.39 25.66 Favored 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 122.311 2.007 . . . . 0.0 112.806 -178.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . 0.549 ' O ' ' HB2' ' A' ' 21' ' ' LYS . . . 75.98 -8.84 20.79 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.475 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 4.6 m -104.81 -172.33 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 N-CA-C 110.518 -0.179 . . . . 0.0 110.518 179.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.673 ' HG2' HE22 ' A' ' 20' ' ' GLN . 9.0 mttt -59.8 90.68 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.925 0.393 . . . . 0.0 110.625 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.444 ' HB3' ' O ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -81.11 132.12 35.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.0 -179.222 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 92.99 -55.53 2.55 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.489 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -101.91 169.91 8.48 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.873 0.368 . . . . 0.0 110.955 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.19 -0.91 . . . . 0.0 111.052 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.31 0 N-CA-C 112.515 -0.234 . . . . 0.0 112.515 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.68 123.28 9.97 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.516 2.144 . . . . 0.0 112.217 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 mp -91.71 155.06 18.56 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.972 -179.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -89.26 26.07 9.5 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.467 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.551 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 23.6 t -77.51 -50.92 1.98 Allowed Pre-proline 0 C--N 1.329 -0.29 0 N-CA-C 111.36 0.133 . . . . 0.0 111.36 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.551 ' HD2' ' N ' ' A' ' 5' ' ' SER . 39.9 Cg_endo -66.4 108.6 1.41 Allowed 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 122.108 1.872 . . . . 0.0 111.975 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.478 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.5 OUTLIER -93.92 -48.42 6.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.244 -179.238 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.721 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 3.0 t -87.85 -34.79 18.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.717 -178.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.453 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.18 -36.1 74.74 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 177.406 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.8 t -70.21 -34.81 73.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.729 177.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.721 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 4.1 mtm -64.36 -35.34 80.56 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.823 177.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.753 HD11 ' HB3' ' A' ' 24' ' ' LEU . 3.8 mp -52.47 -51.21 60.49 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.994 178.769 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.96 -26.92 67.79 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.778 178.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.7 15.85 27.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.688 -178.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.883 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -134.51 56.14 16.98 Favored Pre-proline 0 CA--C 1.534 0.335 0 CA-C-O 120.546 0.212 . . . . 0.0 111.272 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.536 ' HD3' ' N ' ' A' ' 15' ' ' ALA . 48.4 Cg_exo -57.42 -49.69 12.98 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.68 2.253 . . . . 0.0 113.938 -178.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.446 ' HD3' ' HB2' ' A' ' 16' ' ' PRO . 22.9 Cg_exo -65.33 -161.04 0.04 OUTLIER 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 122.145 1.896 . . . . 0.0 112.501 -178.742 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -73.76 66.05 1.07 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.635 179.161 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.883 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 1.3 tp10 -104.6 9.65 35.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.782 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.604 HE22 ' HG2' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -47.72 -62.17 1.58 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.424 -178.423 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.85 ' HE3' ' HA ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER -55.73 -20.92 16.3 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.895 -177.049 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.642 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 23.5 tt0 -73.81 -80.3 0.08 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.013 0.435 . . . . 0.0 111.683 179.309 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.736 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -70.16 -96.84 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.04 0.755 . . . . 0.0 113.04 -176.453 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.753 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -57.69 0.83 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -175.422 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.587 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.86 -118.06 11.63 Favored Glycine 0 N--CA 1.446 -0.681 0 N-CA-C 108.349 -1.901 . . . . 0.0 108.349 -174.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.508 ' HG3' ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -76.07 -67.31 0.69 Allowed 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 168.713 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.73 ' HD3' HD12 ' A' ' 24' ' ' LEU . 0.3 OUTLIER -160.09 8.12 0.1 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.262 -1.335 . . . . 0.0 108.142 175.278 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 1.028 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.3 OUTLIER -59.28 -78.21 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.305 -1.316 . . . . 0.0 113.942 -173.656 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.637 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -33.67 -48.88 0.75 Allowed Pre-proline 0 CA--C 1.535 0.397 0 N-CA-C 113.758 1.022 . . . . 0.0 113.758 -175.147 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.613 ' HG3' ' HB2' ' A' ' 24' ' ' LEU . 18.9 Cg_endo -61.01 -42.86 33.63 Favored 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 122.137 1.891 . . . . 0.0 113.291 -178.052 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.72 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.36 -44.9 64.13 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 119.956 -0.698 . . . . 0.0 110.153 -179.566 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.725 HD11 HD23 ' A' ' 28' ' ' LEU . 0.5 OUTLIER -73.05 -14.46 16.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 CA-C-N 116.233 -0.44 . . . . 0.0 109.891 178.018 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.642 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 4.4 tp-100 -62.41 -38.69 90.64 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 176.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.42 -30.12 69.79 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.327 -0.851 . . . . 0.0 108.939 174.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.596 ' HE2' ' HE ' ' A' ' 66' ' ' ARG . 6.8 mtt -102.18 26.28 7.87 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.209 177.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.642 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.9 p-80 -64.59 -32.08 6.57 Favored Pre-proline 0 CA--C 1.536 0.41 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 -177.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.586 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 44.4 Cg_exo -35.1 -34.06 0.1 OUTLIER 'Trans proline' 0 C--N 1.363 1.317 0 C-N-CA 122.24 1.96 . . . . 0.0 112.319 178.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.61 HG22 HD12 ' A' ' 76' ' ' LEU . 52.6 m -78.52 -87.61 0.06 Allowed 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.678 176.358 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.55 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 0.1 OUTLIER -171.47 63.78 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.49 178.102 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.511 ' HA ' HD12 ' A' ' 43' ' ' ILE . . . -47.96 -34.69 9.56 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 120.873 0.368 . . . . 0.0 111.622 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.637 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -51.5 -56.93 13.16 Favored Glycine 0 CA--C 1.518 0.23 0 CA-C-N 115.948 -0.569 . . . . 0.0 114.034 -178.379 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.6 ' HE2' ' SD ' ' A' ' 46' ' ' MET . 2.5 tptm -75.6 -35.65 60.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 117.034 0.417 . . . . 0.0 111.686 -177.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.661 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 41.2 mt -54.02 -59.48 2.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.139 -179.37 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 1.028 ' HA ' HD22 ' A' ' 28' ' ' LEU . 11.0 t -47.82 -43.12 27.71 Favored 'General case' 0 CA--C 1.522 -0.129 0 CA-C-O 120.85 0.357 . . . . 0.0 110.444 178.863 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.696 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -48.23 -71.79 0.53 Allowed Glycine 0 N--CA 1.45 -0.396 0 CA-C-N 115.738 -0.665 . . . . 0.0 113.232 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.628 ' HE3' HG23 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -55.7 -43.41 76.44 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 117.035 0.417 . . . . 0.0 111.723 -178.399 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.519 ' CD1' ' HB2' ' B' ' 7' ' ' ASN . 3.1 mm? -79.84 5.64 13.15 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.682 0.253 . . . . 0.0 111.682 -178.517 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.64 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.17 -12.02 53.23 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.868 0.366 . . . . 0.0 110.605 179.627 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.449 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.1 mm-40 -78.0 17.65 0.57 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.364 177.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.419 ' HB ' ' O ' ' A' ' 47' ' ' LEU . 0.9 OUTLIER -83.45 159.46 3.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.1 -179.398 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.613 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 3.9 m-20 -71.01 151.1 44.96 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -178.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.806 ' HA ' HD23 ' A' ' 55' ' ' LEU . 2.2 t-20 -80.52 -30.51 37.19 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.679 177.016 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 39.6 m -73.99 -31.87 63.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.662 177.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.613 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 0.9 OUTLIER -76.55 -27.87 56.08 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.536 178.746 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.806 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -59.39 -48.73 80.51 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.355 179.841 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.468 ' HA ' HD22 ' A' ' 56' ' ' LEU . 0.9 OUTLIER -60.7 -43.61 97.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.551 179.614 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -59.59 -32.57 70.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.22 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.473 ' HB3' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -65.94 -45.41 81.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.324 -179.408 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.604 HD23 ' CG ' ' A' ' 27' ' ' ARG . 0.2 OUTLIER -67.15 -16.19 64.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.261 -179.524 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -98.79 -11.13 22.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.869 0.366 . . . . 0.0 110.915 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.59 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -123.68 86.48 52.85 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.864 179.859 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -60.35 -33.37 94.41 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.368 2.045 . . . . 0.0 112.216 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.598 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -77.98 -44.99 25.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.193 -179.723 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.598 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 14.5 m -73.83 -25.97 60.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.934 0.397 . . . . 0.0 111.051 -179.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.592 HD11 HD13 ' A' ' 31' ' ' LEU . 1.9 tp -78.76 -65.69 0.96 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.621 -178.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.596 ' HE ' ' HE2' ' A' ' 35' ' ' MET . 0.1 OUTLIER -51.4 -28.09 11.79 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.973 -178.0 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.576 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 28.7 t -69.42 -42.68 74.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.149 0.499 . . . . 0.0 110.094 178.129 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.655 ' HG2' HD21 ' B' ' 6' ' ' LEU . 2.5 ttmm -66.08 -57.22 8.2 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.55 179.278 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.542 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 52.9 t -64.11 -18.73 23.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.636 179.289 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.616 ' O ' HG22 ' A' ' 73' ' ' VAL . 21.9 t70 -55.65 -49.95 71.52 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 176.552 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.507 ' HB3' HD13 ' B' ' 6' ' ' LEU . 25.7 tt0 -68.53 -24.94 64.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.771 177.159 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.712 ' O ' HG22 ' A' ' 75' ' ' VAL . . . -63.26 -50.58 69.62 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.191 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.616 HG22 ' O ' ' A' ' 70' ' ' ASP . 3.7 m -58.15 -29.19 36.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 178.178 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.413 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -70.09 -36.75 75.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.083 179.004 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.712 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.3 m -59.67 -31.92 48.16 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.123 0 CA-C-O 121.078 0.466 . . . . 0.0 110.016 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.61 HD12 HG22 ' A' ' 38' ' ' THR . 2.4 tm? -71.91 -49.85 34.29 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.317 178.228 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.485 HE21 HG23 ' A' ' 38' ' ' THR . 48.0 mm-40 -54.44 -39.82 67.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.51 179.479 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.48 -19.62 41.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.095 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.562 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 4.0 t60 -63.09 -55.92 21.28 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.016 -179.398 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -74.99 -10.26 59.31 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.961 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.42 -64.26 1.23 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.238 -179.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.75 -17.7 64.8 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.196 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.562 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 0.8 OUTLIER -74.51 -49.01 23.73 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.952 179.89 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -79.4 -8.94 59.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.942 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -79.71 -38.61 33.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.075 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -76.17 -169.5 1.17 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.822 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.82 -21.39 59.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.99 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -81.51 80.69 7.82 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.039 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -95.52 19.82 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.862 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -90.39 128.32 36.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.939 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 5.5 m -80.37 -73.29 0.37 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.016 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -92.01 -174.66 3.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.053 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 13.5 p -108.73 -6.16 16.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.986 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -101.16 -45.92 1.79 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.558 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 10.6 t -103.78 107.31 56.16 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-O 120.622 0.249 . . . . 0.0 111.101 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -70.08 -160.26 0.07 OUTLIER 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.556 2.171 . . . . 0.0 112.331 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.98 -172.09 3.93 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.938 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 21.7 t . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.059 -0.972 . . . . 0.0 111.055 179.967 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.795 0.331 . . . . 0.0 111.077 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 8.7 p -79.56 142.26 14.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.089 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.76 90.48 5.67 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.03 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . 0.467 ' HB2' ' O ' ' B' ' 7' ' ' ASN . 0.0 OUTLIER -87.78 173.25 9.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.736 179.683 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' ASN . . . . . 0.503 ' HB2' HG12 ' A' ' 75' ' ' VAL . 7.3 m120 -104.17 -72.23 0.71 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.291 -179.089 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.655 HD21 ' HG2' ' A' ' 68' ' ' LYS . 6.0 tp -62.43 -82.44 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.612 -179.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . 0.565 HD22 ' H ' ' B' ' 9' ' ' ASN . 2.3 t30 -75.22 136.46 72.42 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.651 178.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.72 -10.72 18.49 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 122.117 1.878 . . . . 0.0 111.819 178.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' ASN . . . . . 0.565 ' H ' HD22 ' B' ' 7' ' ' ASN . 4.0 m120 -123.93 63.25 1.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.769 179.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . 0.474 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.15 92.06 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.561 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.541 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.2 OUTLIER -118.66 123.64 45.43 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.284 178.592 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . 0.514 ' HG2' ' HE3' ' A' ' 42' ' ' LYS . 8.5 mt-10 -47.97 172.14 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.251 0.548 . . . . 0.0 112.366 -178.149 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' PHE . . . . . 0.696 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.5 OUTLIER -87.42 79.94 8.27 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.799 179.088 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.949 ' H ' ' HD2' ' B' ' 15' ' ' PRO . 1.2 m -113.42 -45.14 0.07 OUTLIER Pre-proline 0 CA--C 1.538 0.484 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -176.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' PRO . . . . . 0.949 ' HD2' ' H ' ' B' ' 14' ' ' VAL . 3.8 Cg_endo -46.75 -39.56 23.9 Favored 'Trans proline' 0 C--N 1.355 0.909 0 C-N-CA 122.425 2.083 . . . . 0.0 112.543 -178.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.68 -29.05 2.36 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.547 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.85 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.2 OUTLIER -94.92 -171.92 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 120.538 0.209 . . . . 0.0 110.689 179.77 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.604 ' HG2' HE22 ' A' ' 20' ' ' GLN . 4.3 mtmp? -60.01 93.79 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.879 0.371 . . . . 0.0 110.985 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -85.88 100.54 12.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.049 -179.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 91.54 76.65 1.33 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.458 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -95.5 13.31 26.46 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.785 0.326 . . . . 0.0 111.071 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.26 -0.876 . . . . 0.0 111.015 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.199 0 N-CA-C 112.41 -0.276 . . . . 0.0 112.41 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -70.97 112.88 3.4 Favored 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.586 2.191 . . . . 0.0 112.199 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.2 mp -91.63 164.11 13.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.904 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -103.61 112.27 4.15 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.783 -0.723 . . . . 0.0 112.55 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 56.9 p -76.52 137.59 67.33 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-O 120.529 0.204 . . . . 0.0 110.964 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -67.13 129.98 21.75 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.495 2.13 . . . . 0.0 112.185 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.463 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.8 OUTLIER -87.31 -74.73 0.43 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.052 -179.695 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.729 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 4.8 t -87.94 -28.84 21.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.552 -179.395 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.451 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.45 -39.02 82.26 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 177.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.14 -34.83 73.54 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.651 177.221 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.729 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 3.2 mtm -64.46 -34.78 78.99 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.765 177.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.646 HD21 ' NH1' ' A' ' 27' ' ' ARG . 1.9 mp -52.58 -52.18 56.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.111 178.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.88 -26.25 67.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.781 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -101.83 15.78 27.93 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.699 -179.005 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.98 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -134.11 55.78 16.54 Favored Pre-proline 0 CA--C 1.532 0.276 0 CA-C-N 116.71 -0.223 . . . . 0.0 111.446 -179.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.544 ' HD3' ' N ' ' A' ' 15' ' ' ALA . 46.5 Cg_exo -58.09 -49.46 12.6 Favored 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 122.726 2.284 . . . . 0.0 113.955 -178.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.464 ' HD2' ' N ' ' A' ' 16' ' ' PRO . 53.2 Cg_endo -68.52 -158.48 0.04 OUTLIER 'Trans proline' 0 C--N 1.354 0.852 0 C-N-CA 122.057 1.838 . . . . 0.0 112.484 -178.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.0 mm-40 -73.94 63.34 0.92 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.956 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.98 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 2.1 tp10 -104.55 14.62 29.62 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.817 -179.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.632 HE22 ' HG2' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -53.47 -62.79 1.42 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.356 -179.468 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.576 ' HE3' ' HA ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER -55.63 -20.68 14.67 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.361 -178.079 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.691 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 0.8 OUTLIER -73.94 -78.63 0.09 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.04 0.448 . . . . 0.0 111.37 178.636 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.613 ' SD ' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.24 -96.35 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -176.665 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.589 ' HB2' ' CG ' ' A' ' 30' ' ' PRO . 0.4 OUTLIER -61.4 1.52 0.2 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -175.038 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.532 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 65.08 -117.18 9.86 Favored Glycine 0 N--CA 1.444 -0.794 0 N-CA-C 108.344 -1.903 . . . . 0.0 108.344 -174.3 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.425 ' O ' HD13 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -75.9 -66.81 0.74 Allowed 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 169.345 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.905 ' HG3' HD21 ' A' ' 31' ' ' LEU . 22.1 tpt180 -160.36 5.51 0.08 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.273 -1.33 . . . . 0.0 107.89 176.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.971 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.28 -74.6 0.07 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.169 -1.378 . . . . 0.0 114.394 -172.554 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.715 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.2 OUTLIER -33.17 -49.1 0.64 Allowed Pre-proline 0 CA--C 1.542 0.639 0 N-CA-C 113.256 0.835 . . . . 0.0 113.256 -175.204 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.589 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 38.0 Cg_exo -61.82 -40.15 46.94 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 122.513 2.142 . . . . 0.0 113.669 -178.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.976 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.13 -47.76 60.36 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 -179.347 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.646 HD11 HD23 ' A' ' 28' ' ' LEU . 0.5 OUTLIER -73.1 -13.2 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.637 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.878 177.478 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.654 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 45.7 tt0 -62.41 -41.04 98.38 Favored 'General case' 0 CA--C 1.518 -0.256 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 177.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.85 -29.97 70.02 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 175.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.533 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 4.7 mtt -101.75 26.19 7.72 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.23 178.191 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.654 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 3.2 p-80 -62.38 -32.76 10.07 Favored Pre-proline 0 CA--C 1.537 0.479 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -176.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.558 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 55.0 Cg_exo -36.43 -30.78 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.282 0 C-N-CA 122.151 1.901 . . . . 0.0 112.211 179.171 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.799 HG21 HG13 ' A' ' 73' ' ' VAL . 3.5 m -78.21 -89.13 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.73 176.474 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.518 HD12 ' H ' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -171.51 59.44 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.168 177.975 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.467 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -43.57 -39.47 3.49 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.6 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.6 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.83 -56.49 9.83 Favored Glycine 0 C--N 1.329 0.186 0 CA-C-N 116.044 -0.525 . . . . 0.0 113.818 -179.186 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.643 ' HE2' ' SD ' ' A' ' 46' ' ' MET . 2.8 tptm -77.46 -37.48 51.36 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 -178.048 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.644 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 45.7 mt -53.74 -57.0 6.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.007 -178.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.971 ' HA ' HD22 ' A' ' 28' ' ' LEU . 9.8 t -49.25 -40.25 33.41 Favored 'General case' 0 N--CA 1.457 -0.115 0 CA-C-O 121.006 0.432 . . . . 0.0 110.073 177.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.752 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -50.33 -68.68 1.33 Allowed Glycine 0 N--CA 1.45 -0.426 0 CA-C-N 115.572 -0.74 . . . . 0.0 112.927 179.635 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.643 ' SD ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.19 -46.4 75.85 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -178.5 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.526 HD12 ' HB2' ' B' ' 7' ' ' ASN . 2.8 mm? -80.23 7.29 9.72 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 111.698 0.259 . . . . 0.0 111.698 -179.063 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.631 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.23 -13.24 60.03 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.9 0.381 . . . . 0.0 110.637 179.585 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.546 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 3.3 mt-10 -78.3 19.28 0.46 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.484 178.252 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.864 HD11 ' NZ ' ' A' ' 68' ' ' LYS . 2.3 tt -83.12 163.5 2.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.02 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.685 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 3.6 m-20 -71.12 158.95 35.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.731 -179.418 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.771 ' HA ' HD23 ' A' ' 55' ' ' LEU . 4.8 m120 -88.41 -29.08 20.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.837 -0.619 . . . . 0.0 109.676 176.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.91 -30.36 62.55 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 177.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.685 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 0.4 OUTLIER -76.93 -29.2 55.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.522 178.675 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.771 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -59.32 -47.49 85.2 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.986 0.422 . . . . 0.0 110.364 179.777 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.444 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 1.3 tm? -60.7 -41.65 95.62 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.474 179.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.538 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 0.2 OUTLIER -61.69 -41.8 98.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.615 179.101 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.59 ' HE2' ' HA ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -62.09 -36.72 82.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.128 178.749 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.783 HD12 ' NE ' ' A' ' 27' ' ' ARG . 4.4 tt -71.09 -19.79 62.42 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.407 178.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.538 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 2.6 pt-20 -106.01 -2.46 22.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.148 -179.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.59 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 9.1 m -123.16 78.87 52.23 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.933 -179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -55.79 -36.47 95.31 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.124 1.883 . . . . 0.0 112.059 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.459 ' HG2' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.7 -46.6 18.68 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.883 -179.065 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.59 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 14.1 m -71.15 -50.46 33.18 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.952 0.406 . . . . 0.0 111.311 -178.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.976 HD21 HD13 ' A' ' 31' ' ' LEU . 0.0 OUTLIER -57.95 -56.9 16.05 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.874 -179.242 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.639 ' N ' HD13 ' A' ' 65' ' ' LEU . 2.2 ttm180 -51.56 -30.78 22.03 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.744 -178.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.502 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 5.9 t -69.66 -38.54 77.14 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.031 0.444 . . . . 0.0 110.327 178.322 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.864 ' NZ ' HD11 ' A' ' 50' ' ' ILE . 8.7 mtpp -65.41 -58.55 5.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.189 178.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.46 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 49.5 t -62.75 -21.58 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.616 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.502 ' HB3' ' O ' ' A' ' 67' ' ' SER . 13.4 t0 -54.46 -48.97 71.14 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 177.089 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.436 ' O ' HG13 ' A' ' 75' ' ' VAL . 21.6 tt0 -68.76 -32.62 72.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.602 176.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.644 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -58.29 -35.32 71.63 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.393 178.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.799 HG13 HG21 ' A' ' 38' ' ' THR . 25.3 t -67.0 -33.02 60.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.662 177.613 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.35 -38.01 71.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.123 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.58 HG22 ' O ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -56.78 -33.38 40.81 Favored 'Isoleucine or valine' 0 C--O 1.231 0.092 0 CA-C-O 121.187 0.517 . . . . 0.0 109.916 179.17 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.744 HD12 HG22 ' A' ' 38' ' ' THR . 2.9 tm? -69.37 -49.87 51.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.525 178.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -54.14 -35.44 62.23 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.601 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.0 -26.85 36.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.705 178.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.512 ' O ' ' HB3' ' A' ' 83' ' ' GLU . 5.0 t60 -67.3 -62.55 1.37 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.797 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -63.41 -13.41 39.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.08 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -72.53 -57.72 3.93 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.063 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 1.4 mmtt -79.47 -16.1 56.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.879 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.512 ' HB3' ' O ' ' A' ' 79' ' ' HIS . 1.5 tt0 -79.73 -48.84 12.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.791 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -70.22 -10.29 58.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.205 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.71 -58.4 6.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.127 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -93.82 142.61 27.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.907 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.31 -6.22 56.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.983 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -87.43 100.58 12.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.97 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -103.51 177.17 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.98 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -94.54 135.17 36.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.942 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.57 116.57 12.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.85 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.31 132.71 38.75 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.093 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -118.67 31.3 6.73 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.822 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -96.39 77.52 0.74 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.605 -179.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.539 ' N ' ' HD2' ' A' ' 96' ' ' PRO . 61.8 t -86.67 -51.27 0.45 Allowed Pre-proline 0 C--N 1.329 -0.292 0 N-CA-C 111.416 0.154 . . . . 0.0 111.416 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.539 ' HD2' ' N ' ' A' ' 95' ' ' VAL . 38.1 Cg_endo -66.0 -29.73 48.58 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.114 1.876 . . . . 0.0 112.135 179.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -106.96 104.17 13.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.933 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 7.3 t . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.028 -0.987 . . . . 0.0 111.009 179.949 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 11.2 t . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.833 0.349 . . . . 0.0 110.934 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . 0.415 ' CG1' ' HB3' ' B' ' 10' ' ' ALA . 3.9 t -90.94 87.8 2.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.059 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 5.7 tttp -86.77 54.03 3.03 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.815 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . 0.641 ' HB3' ' HB2' ' B' ' 10' ' ' ALA . 1.1 p -84.91 132.85 34.32 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.018 -179.688 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -105.23 -46.78 4.14 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.702 179.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.439 ' HA ' HD12 ' B' ' 6' ' ' LEU . 3.3 tp -70.84 -83.23 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.601 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . 0.601 HD22 ' H ' ' B' ' 9' ' ' ASN . 1.6 t30 -76.02 134.43 71.35 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.694 178.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -79.87 -8.32 14.46 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 122.327 2.018 . . . . 0.0 112.305 179.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' ASN . . . . . 0.601 ' H ' HD22 ' B' ' 7' ' ' ASN . 73.9 m-20 -123.67 57.46 1.18 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.012 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . 0.641 ' HB2' ' HB3' ' B' ' 4' ' ' SER . . . -60.15 95.88 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.379 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.546 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -125.01 131.82 53.34 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.585 179.004 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -47.66 167.68 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 121.2 0.524 . . . . 0.0 112.301 -178.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' PHE . . . . . 0.752 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.6 OUTLIER -87.11 83.55 7.43 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.69 179.126 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.595 ' H ' ' HD2' ' B' ' 15' ' ' PRO . 3.3 t -116.55 -50.63 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.343 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -176.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' PRO . . . . . 0.595 ' HD2' ' H ' ' B' ' 14' ' ' VAL . 98.8 Cg_exo -44.48 -36.73 10.12 Favored 'Trans proline' 0 C--N 1.353 0.771 0 C-N-CA 122.327 2.018 . . . . 0.0 112.791 -178.547 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . 0.533 ' O ' ' HB2' ' A' ' 21' ' ' LYS . . . 76.48 -20.06 2.87 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.472 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.576 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 27.7 m -96.99 -171.46 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.546 0.212 . . . . 0.0 110.662 179.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.632 ' HG2' HE22 ' A' ' 20' ' ' GLN . 3.6 mttp -60.21 91.45 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.822 0.344 . . . . 0.0 110.84 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.405 ' HD1' ' HA ' ' B' ' 19' ' ' TYR . 0.1 OUTLIER -80.25 129.8 34.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.841 -179.933 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 92.19 17.49 46.65 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.363 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 60.8 t30 -86.69 52.92 2.64 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.907 0.384 . . . . 0.0 110.872 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 1.5 pt . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.137 -179.949 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.191 0 CA-C-O 120.137 -0.257 . . . . 0.0 112.535 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -72.29 -37.89 4.1 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.519 2.146 . . . . 0.0 112.39 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.26 106.26 12.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.034 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -81.54 80.41 1.74 Allowed Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.399 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.568 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 18.5 t -87.93 -50.46 0.42 Allowed Pre-proline 0 CA--C 1.533 0.305 0 N-CA-C 111.559 0.207 . . . . 0.0 111.559 -179.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.568 ' HD2' ' N ' ' A' ' 5' ' ' SER . 33.6 Cg_endo -64.24 -31.12 64.12 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 122.215 1.944 . . . . 0.0 112.289 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.442 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.3 OUTLIER -96.68 119.14 34.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.078 -179.763 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.782 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 5.2 t -88.0 -30.11 20.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.336 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.14 -37.07 76.37 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 176.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 17.3 t -70.1 -35.92 74.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.566 177.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.782 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 8.7 mtm -64.43 -35.52 81.19 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.129 177.732 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.558 ' HA ' ' HE2' ' A' ' 23' ' ' MET . 44.7 mt -52.71 -50.19 63.85 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.915 179.054 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.18 -28.83 69.06 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.875 177.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -101.76 23.92 10.63 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.931 -178.537 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.637 ' HB1' ' CB ' ' A' ' 19' ' ' GLU . . . -134.32 60.92 46.89 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 120.626 0.251 . . . . 0.0 110.851 179.427 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.496 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 51.8 Cg_exo -56.64 -50.53 11.48 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 122.742 2.295 . . . . 0.0 113.86 -178.237 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.496 ' HD3' ' HB2' ' A' ' 16' ' ' PRO . 20.0 Cg_exo -65.81 -165.24 0.08 OUTLIER 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 121.98 1.787 . . . . 0.0 112.274 -179.04 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -74.23 62.03 0.91 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.587 178.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.637 ' CB ' ' HB1' ' A' ' 15' ' ' ALA . 1.9 mm-40 -93.81 5.74 50.67 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.086 -179.003 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.516 ' O ' HD12 ' A' ' 24' ' ' LEU . 2.8 pp0? -46.9 -56.49 6.25 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.412 -177.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.948 ' HD2' ' HA ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER -56.15 -29.02 60.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.176 -179.163 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 14.9 tp60 -72.65 -73.86 0.19 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.483 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.594 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.41 -97.87 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -176.926 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.686 HD22 ' HD3' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -62.22 3.65 0.17 Allowed 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -174.914 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.5 -118.7 13.22 Favored Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 108.274 -1.931 . . . . 0.0 108.274 -174.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.624 ' HG2' HG22 ' A' ' 50' ' ' ILE . 0.4 OUTLIER -75.59 -66.37 0.79 Allowed 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 106.962 -1.496 . . . . 0.0 106.962 168.105 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.686 ' HD3' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -159.81 5.99 0.09 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.009 -1.45 . . . . 0.0 108.0 174.164 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.902 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.4 OUTLIER -59.64 -77.62 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.271 -1.331 . . . . 0.0 114.354 -173.061 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.576 ' CD2' HG21 ' A' ' 44' ' ' THR . 0.1 OUTLIER -33.15 -48.45 0.61 Allowed Pre-proline 0 CA--C 1.539 0.538 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -174.636 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.586 ' HD3' ' HA ' ' A' ' 24' ' ' LEU . 19.2 Cg_endo -62.13 -43.45 24.09 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.22 1.947 . . . . 0.0 113.448 -178.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.805 HD13 HG21 ' A' ' 69' ' ' VAL . 0.0 OUTLIER -71.32 -44.62 64.77 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 119.816 -0.754 . . . . 0.0 109.984 -179.645 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.576 HD11 HD23 ' A' ' 28' ' ' LEU . 0.5 OUTLIER -72.23 -13.34 16.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 177.689 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.641 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 57.7 tp60 -62.53 -41.75 99.07 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 176.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.83 -28.03 68.03 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 175.085 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.524 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 5.9 mtt -102.75 25.4 9.26 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.228 178.291 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.641 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 2.2 p-80 -64.39 -31.69 6.23 Favored Pre-proline 0 CA--C 1.536 0.421 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -176.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.561 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 51.8 Cg_exo -36.11 -31.74 0.1 OUTLIER 'Trans proline' 0 C--N 1.363 1.318 0 C-N-CA 122.125 1.884 . . . . 0.0 112.061 179.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.802 HG21 HG13 ' A' ' 73' ' ' VAL . 6.9 m -78.21 -88.92 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.578 176.144 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.616 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 7.7 tp -171.7 62.64 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.131 177.371 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.487 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -45.02 -41.2 7.22 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.544 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.526 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -52.17 -51.62 40.4 Favored Glycine 0 C--N 1.329 0.192 0 C-N-CA 121.172 -0.537 . . . . 0.0 113.587 -179.222 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.46 ' HA ' ' HD2' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -77.42 -40.44 43.49 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 122.719 -0.283 . . . . 0.0 111.68 -178.594 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.64 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 65.7 mt -53.7 -54.53 18.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.83 -179.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.902 ' HA ' HD22 ' A' ' 28' ' ' LEU . 11.4 t -53.47 -41.26 66.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.362 178.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.647 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -51.62 -67.45 1.99 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 121.009 -0.615 . . . . 0.0 112.85 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.557 ' HG3' HD22 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -55.35 -47.0 76.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.712 0.256 . . . . 0.0 111.575 -179.022 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.557 HD22 ' HG3' ' A' ' 46' ' ' MET . 3.1 mm? -80.28 8.23 7.85 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.625 0.231 . . . . 0.0 111.625 -179.216 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.647 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.1 OUTLIER -64.54 -13.26 51.81 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 121.017 0.437 . . . . 0.0 110.111 179.406 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.483 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.5 mt-10 -78.67 20.64 0.43 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.377 177.211 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.624 HG22 ' HG2' ' A' ' 26' ' ' GLU . 0.3 OUTLIER -83.26 157.03 3.79 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.672 -179.457 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.65 155.47 40.46 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.905 0.383 . . . . 0.0 111.745 -178.278 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.895 ' HA ' HD23 ' A' ' 55' ' ' LEU . 3.1 m120 -85.61 -28.98 24.45 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.06 177.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 62.6 m -74.19 -29.96 62.0 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.721 177.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.566 ' O ' ' HG2' ' A' ' 58' ' ' MET . 2.6 mm-40 -79.88 -29.39 39.96 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.638 179.062 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.895 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -58.99 -46.88 87.05 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.132 179.757 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.458 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 26.9 tp -62.16 -45.55 92.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.617 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -59.62 -28.49 67.26 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.17 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.629 ' SD ' ' HA ' ' A' ' 65' ' ' LEU . 32.1 mmt -69.51 -49.05 58.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.377 -179.375 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.528 ' HG ' ' CZ ' ' A' ' 27' ' ' ARG . 0.2 OUTLIER -64.38 -21.23 66.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.092 -179.576 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -96.38 -4.56 41.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.062 0.458 . . . . 0.0 110.41 178.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.58 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 11.9 m -124.18 78.39 59.96 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.803 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -55.79 -33.73 88.99 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.138 1.892 . . . . 0.0 112.146 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -78.13 -49.44 13.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.828 -179.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.58 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 39.2 m -69.45 -45.38 69.21 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.853 0.359 . . . . 0.0 111.444 -178.272 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.658 HD11 HD13 ' A' ' 31' ' ' LEU . 0.6 OUTLIER -57.92 -66.72 0.43 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.409 -178.835 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.65 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -47.06 -31.47 3.38 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.924 -178.884 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.529 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.5 OUTLIER -65.36 -44.27 88.18 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.164 0.507 . . . . 0.0 109.986 177.714 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.512 ' O ' HD11 ' B' ' 6' ' ' LEU . 0.2 OUTLIER -65.86 -59.85 3.45 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.555 178.791 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.805 HG21 HD13 ' A' ' 31' ' ' LEU . 78.8 t -61.05 -19.67 20.46 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.018 179.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.529 ' HB3' ' O ' ' A' ' 67' ' ' SER . 7.1 t70 -55.7 -49.42 73.06 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 176.174 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.458 ' O ' HG13 ' A' ' 75' ' ' VAL . 22.2 tt0 -66.12 -32.53 74.03 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.677 176.239 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.65 ' O ' HG22 ' A' ' 75' ' ' VAL . . . -57.74 -37.07 72.97 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.31 178.639 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.802 HG13 HG21 ' A' ' 38' ' ' THR . 24.6 t -65.04 -32.57 58.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.642 177.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.05 -36.62 66.93 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.205 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.65 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.85 -29.45 40.49 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.129 0 CA-C-O 121.02 0.438 . . . . 0.0 110.098 179.111 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.633 HD12 HG22 ' A' ' 38' ' ' THR . 2.6 tm? -70.34 -51.01 33.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.375 178.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -58.06 -35.54 71.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.457 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.27 -17.91 47.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.006 179.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.518 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 56.9 t-80 -69.55 -61.43 1.79 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.966 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -64.79 -24.83 67.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.073 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -72.7 -54.16 9.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.2 -179.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.77 -18.13 62.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.111 -179.448 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.518 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 2.4 tp10 -80.16 -50.99 9.51 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.924 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -68.78 -25.96 64.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.082 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -84.19 25.46 0.84 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.262 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.416 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 2.5 mm-40 -89.18 34.57 0.8 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.861 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.2 mtmp? -85.41 115.95 23.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.931 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -89.71 9.04 28.64 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.052 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 14.1 p -88.43 -26.22 5.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.996 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -82.11 120.24 25.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.899 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.4 m -81.05 -77.45 0.21 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.893 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -92.71 147.25 23.02 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.043 179.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -116.39 89.5 3.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.994 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -98.32 64.29 0.81 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.366 179.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 16.5 t -105.51 100.81 28.35 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 120.657 0.265 . . . . 0.0 111.087 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -74.57 -170.06 0.69 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.512 2.142 . . . . 0.0 112.291 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -107.22 -78.44 0.58 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.001 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 7.1 p . . . . . 0 C--O 1.249 1.078 0 CA-C-O 117.987 -1.006 . . . . 0.0 111.054 -179.886 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 2.8 m . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.873 0.368 . . . . 0.0 111.091 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 12.1 p -83.36 146.95 6.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.043 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 4.9 mtpp -95.31 89.09 5.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.895 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . 0.456 ' HB2' ' O ' ' B' ' 7' ' ' ASN . 0.9 OUTLIER -81.6 -161.91 0.47 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.893 -179.815 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' ASN . . . . . 0.593 ' HB2' HG12 ' A' ' 75' ' ' VAL . 2.6 m-80 -104.07 -83.37 0.49 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.914 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.512 HD11 ' O ' ' A' ' 68' ' ' LYS . 3.4 mt -62.72 -80.18 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.583 179.572 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . 0.58 HD22 ' H ' ' B' ' 9' ' ' ASN . 2.7 t30 -75.02 142.34 75.95 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.556 178.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -78.98 -12.18 14.71 Favored 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.318 2.012 . . . . 0.0 112.122 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' ASN . . . . . 0.585 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 69.9 m-20 -123.96 60.72 1.11 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.163 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.86 96.11 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.616 179.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.585 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.0 OUTLIER -122.47 129.05 51.61 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.37 178.433 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -48.17 173.44 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.115 0.483 . . . . 0.0 112.126 -178.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' PHE . . . . . 0.483 ' CE1' ' HG ' ' A' ' 48' ' ' LEU . 0.3 OUTLIER -86.92 90.38 8.31 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.867 179.393 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.948 ' H ' ' HD2' ' B' ' 15' ' ' PRO . 0.5 OUTLIER -119.51 -47.63 0.04 OUTLIER Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.798 -176.902 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' PRO . . . . . 0.948 ' HD2' ' H ' ' B' ' 14' ' ' VAL . 9.8 Cg_endo -51.07 -39.71 60.16 Favored 'Trans proline' 0 C--N 1.353 0.777 0 C-N-CA 122.201 1.934 . . . . 0.0 112.582 -178.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . 0.404 ' O ' ' HB2' ' A' ' 21' ' ' LYS . . . 78.44 -23.64 2.81 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.384 -179.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.948 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 1.9 p -94.97 -174.1 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 110.351 -0.24 . . . . 0.0 110.351 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.725 ' H ' HG22 ' B' ' 17' ' ' VAL . 7.6 mttt -59.89 88.71 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.89 0.376 . . . . 0.0 110.63 179.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -81.04 112.8 18.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.941 -179.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 87.69 54.91 2.4 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.514 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -96.57 83.19 3.45 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.876 0.369 . . . . 0.0 110.819 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 1.7 mt . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.311 -0.852 . . . . 0.0 111.05 -179.929 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.186 0 N-CA-C 112.533 -0.227 . . . . 0.0 112.533 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -67.69 98.56 0.5 Allowed 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.591 2.194 . . . . 0.0 112.214 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.7 8.37 20.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.016 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -94.54 20.5 48.05 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.32 179.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.69 ' N ' ' HA ' ' A' ' 6' ' ' PRO . 0.7 OUTLIER -83.49 -38.77 0.73 Allowed Pre-proline 0 CA--C 1.537 0.479 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -179.447 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.69 ' HA ' ' N ' ' A' ' 5' ' ' SER . 10.3 Cg_exo -71.6 -57.24 0.14 OUTLIER 'Cis proline' 0 C--N 1.359 1.086 0 CA-C-N 119.738 0.942 . . . . 0.0 112.974 -0.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.458 ' O ' ' HB2' ' A' ' 5' ' ' SER . 1.9 mt -98.14 -168.28 1.63 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.263 -178.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.849 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 10.8 t -87.68 -29.76 20.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.473 -179.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.435 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.45 -37.2 77.55 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 176.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.3 t -70.56 -33.77 71.48 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.591 177.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.849 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.3 mtm -64.09 -35.74 81.75 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 177.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.559 HD11 ' HB3' ' A' ' 24' ' ' LEU . 1.7 mp -52.32 -54.27 33.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.02 178.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.31 -26.68 67.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.244 178.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.7 p -101.64 15.57 28.51 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.881 -178.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.674 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -134.96 125.05 16.97 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 120.583 0.23 . . . . 0.0 111.209 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -62.8 169.73 8.28 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.456 2.104 . . . . 0.0 111.645 179.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.451 ' O ' ' HG3' ' A' ' 20' ' ' GLN . 17.0 Cg_endo -57.15 -33.04 95.12 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.384 2.056 . . . . 0.0 112.061 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.83 -7.15 51.12 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.306 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.674 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -91.42 19.26 6.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.947 -179.624 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.606 ' NE2' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -54.24 -65.47 0.57 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.265 -179.55 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.618 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -56.34 -19.59 15.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.733 -177.693 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.618 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 16.6 tp60 -72.72 -80.59 0.06 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.028 0.442 . . . . 0.0 111.322 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.663 ' HE2' ' HB3' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -69.91 -95.41 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.658 -177.374 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.582 ' HB2' ' CG ' ' A' ' 30' ' ' PRO . 0.4 OUTLIER -62.46 -2.38 1.04 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -175.06 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.561 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 65.29 -116.35 8.71 Favored Glycine 0 N--CA 1.445 -0.763 0 N-CA-C 108.419 -1.872 . . . . 0.0 108.419 -173.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.65 -69.88 0.49 Allowed 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 169.407 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.699 ' HD2' ' HG2' ' A' ' 30' ' ' PRO . 12.8 tpt180 -160.11 14.33 0.13 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.325 -1.307 . . . . 0.0 107.951 175.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.556 ' O ' HG13 ' A' ' 32' ' ' ILE . 3.9 mm? -57.76 -76.2 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.423 -1.262 . . . . 0.0 113.329 -174.281 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.634 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -39.02 -47.11 3.68 Favored Pre-proline 0 CA--C 1.538 0.517 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -175.815 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.699 ' HG2' ' HD2' ' A' ' 27' ' ' ARG . 52.1 Cg_exo -57.36 -43.31 53.2 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.333 2.022 . . . . 0.0 113.817 -178.145 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.881 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.58 -47.44 60.24 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.395 0.617 . . . . 0.0 109.955 -178.488 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.771 HG21 HD12 ' A' ' 43' ' ' ILE . 0.7 OUTLIER -73.99 -13.15 15.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.227 178.468 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.647 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.2 OUTLIER -62.54 -40.85 98.1 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 176.834 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.13 -30.06 70.47 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 174.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.486 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 6.6 mtt -101.69 25.93 7.96 Favored 'General case' 0 N--CA 1.461 0.09 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.443 178.199 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.647 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.8 p-80 -65.32 -32.87 6.85 Favored Pre-proline 0 CA--C 1.535 0.392 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 -177.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.573 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 57.3 Cg_exo -36.69 -33.01 0.13 Allowed 'Trans proline' 0 C--N 1.36 1.181 0 C-N-CA 122.183 1.922 . . . . 0.0 112.182 179.407 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.473 ' HB ' ' H ' ' A' ' 39' ' ' LEU . 1.1 m -79.06 -86.31 0.07 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.982 -0.553 . . . . 0.0 109.732 176.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.599 ' HB2' HD13 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -171.36 65.03 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.194 0 CA-C-O 120.719 0.295 . . . . 0.0 111.371 177.982 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.543 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -52.62 -29.1 24.24 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.127 179.165 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.62 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -49.49 -56.83 10.24 Favored Glycine 0 N--CA 1.452 -0.234 0 CA-C-N 115.805 -0.634 . . . . 0.0 114.053 -178.38 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.609 ' O ' ' HG2' ' A' ' 46' ' ' MET . 0.0 OUTLIER -77.93 -37.99 46.47 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -177.345 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.792 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 22.0 mt -53.18 -54.19 18.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 C-N-CA 120.952 -0.299 . . . . 0.0 111.562 -177.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.542 HG21 ' CD2' ' A' ' 29' ' ' PHE . 5.1 t -46.8 -49.46 19.89 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.44 ' N ' HG23 ' A' ' 44' ' ' THR . . . -55.16 -48.56 67.56 Favored Glycine 0 N--CA 1.449 -0.451 0 CA-C-N 115.878 -0.601 . . . . 0.0 112.796 178.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.716 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.2 OUTLIER -54.94 -69.78 0.12 Allowed 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.461 0.648 . . . . 0.0 111.066 -179.079 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.855 HD23 ' HB2' ' B' ' 7' ' ' ASN . 2.5 mp -80.03 17.64 0.96 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.832 -177.142 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.592 ' HB3' ' HD2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -65.98 -23.47 66.59 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 121.161 0.505 . . . . 0.0 109.755 177.009 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.547 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 1.2 mt-10 -74.58 23.46 0.09 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.01 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.625 HD11 ' HE3' ' A' ' 68' ' ' LYS . 3.5 tt -84.7 169.52 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.932 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.541 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 30.6 m-20 -70.96 159.59 34.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.615 -179.569 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.85 ' HA ' HD23 ' A' ' 55' ' ' LEU . 8.0 m120 -89.09 -28.31 20.19 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.897 177.232 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -74.05 -30.15 62.26 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 177.144 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.541 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 1.2 mm-40 -78.87 -28.77 44.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.656 178.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.85 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -59.18 -45.93 89.73 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.07 179.6 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.53 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 7.1 tt -60.1 -49.97 75.54 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.6 179.022 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -58.59 -32.05 68.61 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.284 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.565 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -62.85 -55.62 24.66 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.067 -179.77 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 56' ' ' LEU . 2.3 pp -66.14 -6.21 12.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.028 0.442 . . . . 0.0 110.369 178.62 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.522 ' HG3' ' O ' ' A' ' 60' ' ' GLU . 9.4 tp10 -105.12 -13.95 15.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.606 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.534 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -122.66 91.37 49.56 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.966 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.408 ' HD2' ' HA ' ' A' ' 61' ' ' SER . 32.2 Cg_endo -63.79 -31.25 68.57 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.303 2.002 . . . . 0.0 112.151 179.537 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.573 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.61 -45.44 21.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.15 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.573 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 19.1 m -72.73 -56.36 5.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.011 0.434 . . . . 0.0 111.537 -178.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.881 HD21 HD13 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -57.86 -60.69 3.32 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.621 -177.999 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.703 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -51.78 -35.41 43.72 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.22 -177.752 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.533 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 2.8 m -65.52 -37.76 87.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.102 0.477 . . . . 0.0 110.194 178.23 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.625 ' HE3' HD11 ' A' ' 50' ' ' ILE . 0.5 OUTLIER -66.39 -55.08 17.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.574 179.019 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.626 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 61.4 t -67.99 -16.14 20.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.564 179.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.588 ' O ' HG22 ' A' ' 73' ' ' VAL . 8.7 t70 -58.04 -49.46 76.8 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 176.101 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.529 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 0.4 OUTLIER -68.9 -20.07 64.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.734 176.354 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.792 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -65.63 -47.72 74.64 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.732 179.434 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.588 HG22 ' O ' ' A' ' 70' ' ' ASP . 2.4 m -57.17 -30.5 34.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 176.62 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.529 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -68.33 -32.18 72.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.837 178.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.682 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.2 m -60.81 -30.91 48.17 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.131 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 178.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.599 HD13 ' HB2' ' A' ' 39' ' ' LEU . 30.6 mt -67.82 -50.55 56.11 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.271 0.557 . . . . 0.0 109.602 176.276 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -51.53 -39.18 57.21 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.343 179.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 82' ' ' LYS . . . -81.93 -25.11 35.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.848 177.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.432 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 11.9 t-160 -71.27 -25.47 62.47 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.956 -179.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -83.59 -39.57 20.17 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.86 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -73.51 -37.96 65.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.433 -179.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.445 ' HB2' ' O ' ' A' ' 78' ' ' ALA . 3.0 mptm? -73.37 -27.6 61.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.151 -179.29 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.448 ' O ' ' HB2' ' A' ' 87' ' ' LYS . 8.8 tt0 -87.03 -21.4 26.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.006 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -80.09 11.32 3.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.378 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -82.33 -68.33 0.71 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.23 -179.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -81.28 3.81 22.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.067 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.448 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.4 tttm -87.71 127.63 35.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.847 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -83.98 81.21 8.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.989 179.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.6 t -80.15 78.37 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.987 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 31.8 m120 -93.78 97.07 10.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.906 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 27.0 m -83.05 4.56 25.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.914 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.78 96.64 2.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.015 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 12.9 p -92.95 -68.91 0.77 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.915 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -86.11 -117.88 0.99 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.532 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.2 t -81.36 126.61 76.07 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 120.581 0.229 . . . . 0.0 111.086 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -68.86 92.82 0.44 Allowed 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.469 2.112 . . . . 0.0 112.287 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.2 p -89.18 -56.86 3.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.972 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 14.9 p . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.109 -0.948 . . . . 0.0 111.171 -179.926 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 7.2 p . . . . . 0 N--CA 1.485 1.311 0 CA-C-O 120.853 0.359 . . . . 0.0 111.04 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 20.0 t -99.67 108.02 21.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.064 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 21.4 tttt -85.25 112.34 20.67 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.814 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -89.65 -175.49 4.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.038 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -104.96 -36.89 7.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.981 179.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.616 ' HB3' HD21 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -82.78 -79.0 0.2 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.818 179.678 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . 0.855 ' HB2' HD23 ' A' ' 47' ' ' LEU . 6.2 t30 -84.98 127.63 63.76 Favored Pre-proline 0 C--N 1.331 -0.219 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.129 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -80.17 13.48 2.19 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 122.357 2.038 . . . . 0.0 111.884 178.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' ASN . . . . . 0.526 ' HB3' ' OE2' ' A' ' 49' ' ' GLU . 25.8 m-20 -123.61 28.31 7.02 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.31 -179.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . 0.716 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -59.39 96.41 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.818 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.547 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 1.7 mttp -130.11 -178.4 4.72 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.473 178.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -68.87 161.34 28.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.658 0.266 . . . . 0.0 111.061 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' PHE . . . . . 0.431 ' O ' ' HD3' ' B' ' 15' ' ' PRO . 1.0 OUTLIER -88.42 111.15 21.45 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.957 0.408 . . . . 0.0 110.697 179.427 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -112.39 88.79 11.36 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.399 178.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' PRO . . . . . 0.431 ' HD3' ' O ' ' B' ' 13' ' ' PHE . 51.9 Cg_exo -55.06 -176.39 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.814 2.342 . . . . 0.0 112.842 -178.535 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.01 -40.93 3.02 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.522 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 17.1 m -115.45 149.85 17.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.798 0.332 . . . . 0.0 111.301 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.58 ' HG2' HE22 ' A' ' 20' ' ' GLN . 24.0 mttp -74.78 93.05 2.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.516 179.488 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.592 ' HD2' ' HB3' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -65.02 118.42 9.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.983 -179.449 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 91.0 31.83 9.52 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.548 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 14.8 t30 -100.66 -0.19 37.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.843 0.354 . . . . 0.0 110.976 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 2.1 tp . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.255 -0.878 . . . . 0.0 111.007 -179.945 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 112.414 -0.275 . . . . 0.0 112.414 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -80.49 51.46 3.93 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.678 2.252 . . . . 0.0 112.409 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.6 mp -77.89 -44.68 26.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.873 179.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -104.42 -33.53 3.88 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.379 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 34.0 t -80.95 121.59 80.99 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 120.545 0.212 . . . . 0.0 110.871 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.47 ' HB2' ' HB3' ' A' ' 9' ' ' ALA . 47.6 Cg_endo -68.18 147.69 73.32 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.524 2.15 . . . . 0.0 112.233 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.445 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.2 OUTLIER -100.96 -35.73 9.28 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.368 -179.284 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.797 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 8.0 t -87.77 -29.79 20.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.718 -178.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.471 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.55 -38.31 80.73 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 176.703 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.9 t -67.61 -35.04 78.21 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.459 -0.792 . . . . 0.0 109.347 176.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.797 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.7 mtm -64.42 -34.58 78.52 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.945 177.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.51 ' O ' ' HD3' ' A' ' 16' ' ' PRO . 1.2 mp -54.88 -44.83 74.41 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.367 179.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.3 -37.18 84.82 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.884 178.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.28 47.02 0.92 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.989 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.77 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -132.52 -41.55 0.03 OUTLIER Pre-proline 0 CA--C 1.537 0.461 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -177.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.735 ' HA ' ' O ' ' A' ' 17' ' ' PRO . 70.6 Cg_exo -46.35 153.59 1.08 Allowed 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 121.789 1.659 . . . . 0.0 112.814 -176.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.735 ' O ' ' HA ' ' A' ' 16' ' ' PRO . 59.8 Cg_endo -72.12 -101.91 0.0 OUTLIER 'Cis proline' 0 CA--C 1.539 0.751 0 C-N-CA 123.968 -1.263 . . . . 0.0 114.493 2.223 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.18 67.9 1.4 Allowed 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -175.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.77 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 1.4 tp10 -105.97 14.12 28.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.631 0.253 . . . . 0.0 110.838 176.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.614 ' NE2' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -46.88 -55.67 7.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.34 -178.386 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.722 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -56.26 -24.2 41.24 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.84 -178.571 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.558 ' H ' ' HD3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -72.54 -78.36 0.09 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.899 0.38 . . . . 0.0 111.862 -179.299 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.563 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.29 -95.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -176.37 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.563 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -60.39 -0.23 0.23 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -175.353 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 65.18 -115.69 8.02 Favored Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 108.431 -1.868 . . . . 0.0 108.431 -174.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.589 ' HG2' HG22 ' A' ' 50' ' ' ILE . 0.5 OUTLIER -75.52 -70.11 0.45 Allowed 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 168.64 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.699 ' HB2' HD13 ' A' ' 55' ' ' LEU . 12.7 tpt85 -160.37 10.53 0.1 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.152 -1.385 . . . . 0.0 107.67 174.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.995 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -58.88 -72.62 0.1 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 114.236 -1.347 . . . . 0.0 113.778 -173.025 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.675 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -35.81 -49.31 1.48 Allowed Pre-proline 0 CA--C 1.538 0.503 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -176.134 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.508 ' O ' ' HB3' ' A' ' 33' ' ' GLN . 53.0 Cg_exo -58.69 -42.39 54.19 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.436 2.091 . . . . 0.0 113.633 -178.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.944 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.09 -47.64 61.03 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.07 0.462 . . . . 0.0 109.998 -178.559 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.882 HG21 HD12 ' A' ' 43' ' ' ILE . 0.5 OUTLIER -75.07 -12.06 14.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.199 178.258 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.613 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 50.3 tp60 -62.39 -39.23 92.54 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 177.174 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.58 -30.23 67.95 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.011 174.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.582 ' HE1' ' HA ' ' A' ' 66' ' ' ARG . 6.7 mtt -100.55 28.25 5.22 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.333 178.116 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.613 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -64.96 -31.33 5.26 Favored Pre-proline 0 CA--C 1.536 0.433 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.324 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.593 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 55.7 Cg_exo -35.28 -33.03 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.265 0 C-N-CA 122.365 2.043 . . . . 0.0 112.535 179.549 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.402 ' N ' ' O ' ' A' ' 36' ' ' HIS . 67.8 m -78.18 -85.31 0.07 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.122 177.377 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.579 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.2 OUTLIER -171.19 50.85 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.547 179.014 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.484 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -37.02 -38.81 0.2 Allowed 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -179.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.675 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -44.23 -63.74 2.25 Favored Glycine 0 C--N 1.33 0.206 0 CA-C-N 115.998 -0.546 . . . . 0.0 114.208 -179.265 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.845 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.8 OUTLIER -77.48 -27.56 52.0 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.257 0.465 . . . . 0.0 112.257 -177.267 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.882 HD12 HG21 ' A' ' 32' ' ' ILE . 1.2 mt -54.01 -50.51 53.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.662 0.268 . . . . 0.0 111.195 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.995 ' HA ' HD22 ' A' ' 28' ' ' LEU . 10.6 t -55.4 -46.38 76.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.58 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.594 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -50.05 -59.38 7.58 Favored Glycine 0 N--CA 1.452 -0.253 0 CA-C-N 115.986 -0.552 . . . . 0.0 113.234 -179.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.522 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -56.89 -53.51 57.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.659 0.266 . . . . 0.0 111.371 -178.92 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.542 ' HB2' HD21 ' A' ' 28' ' ' LEU . 2.8 mm? -80.3 10.97 3.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.767 -178.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.594 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.48 -20.53 66.39 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.827 0.346 . . . . 0.0 110.613 179.711 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.536 ' HB2' ' ND2' ' B' ' 7' ' ' ASN . 2.2 mt-10 -76.0 21.54 0.17 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.793 179.222 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.589 HG22 ' HG2' ' A' ' 26' ' ' GLU . 0.2 OUTLIER -83.55 163.41 2.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.915 -179.669 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.493 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 1.3 m-20 -70.61 155.67 40.44 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.763 -178.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.873 ' HA ' HD23 ' A' ' 55' ' ' LEU . 5.4 m120 -84.87 -29.94 24.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.861 177.418 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.502 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 18.3 m -74.09 -28.49 61.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.298 0.57 . . . . 0.0 109.677 177.021 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.537 ' O ' ' HG2' ' A' ' 58' ' ' MET . 0.2 OUTLIER -80.16 -28.28 38.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.402 178.839 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.873 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.8 OUTLIER -59.7 -47.52 85.33 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.684 -179.699 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.533 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 1.0 OUTLIER -64.31 -43.24 95.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.725 179.955 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 9.1 m-70 -58.8 -21.83 56.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.118 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.638 ' HB3' ' HG ' ' A' ' 65' ' ' LEU . 28.2 mmt -76.59 -49.54 16.07 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.472 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.58 HD22 ' HE ' ' A' ' 27' ' ' ARG . 2.6 pp -66.14 -10.63 42.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.673 0.273 . . . . 0.0 110.895 -179.703 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -106.8 -5.52 18.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.707 178.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.6 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 3.6 m -122.52 81.83 47.14 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.946 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -58.49 -33.74 98.23 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.239 1.959 . . . . 0.0 111.83 179.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -78.51 -48.84 14.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.82 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.6 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 15.5 m -70.98 -53.36 15.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.888 0.375 . . . . 0.0 111.533 -177.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.944 HD21 HD13 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -58.01 -61.39 2.58 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.434 -178.405 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.681 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.8 OUTLIER -49.69 -34.54 18.89 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.141 -177.679 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 15.1 m -68.37 -39.18 81.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.248 0.547 . . . . 0.0 110.149 178.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.615 ' HE2' ' SD ' ' A' ' 58' ' ' MET . 0.2 OUTLIER -65.99 -56.35 12.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.552 179.201 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.544 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 21.0 t -63.87 -20.74 27.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.345 178.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.641 ' O ' HG22 ' A' ' 73' ' ' VAL . 21.4 t70 -53.88 -48.68 69.83 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 176.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.491 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 1.6 tt0 -68.28 -29.47 68.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.937 176.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.586 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -58.35 -47.22 84.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.001 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.843 ' HA ' HD13 ' A' ' 43' ' ' ILE . 2.0 m -58.84 -31.72 45.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 177.56 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -69.03 -39.39 79.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.3 179.711 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.545 HG12 ' HB2' ' B' ' 5' ' ' ASN . 0.9 OUTLIER -55.73 -29.74 25.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-O 120.948 0.404 . . . . 0.0 109.917 179.487 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.845 HD11 ' HB3' ' A' ' 42' ' ' LYS . 3.5 mm? -71.84 -51.01 24.58 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.338 177.341 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.497 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 44.4 mm-40 -50.75 -34.76 28.46 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.223 -0.898 . . . . 0.0 110.004 179.236 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -82.0 -31.33 31.13 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.684 177.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.461 ' O ' ' HB3' ' A' ' 83' ' ' GLU . 1.6 t60 -60.13 -65.55 0.66 Allowed 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.055 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -67.51 -2.7 6.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.091 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.497 ' HB2' ' O ' ' A' ' 77' ' ' GLN . . . -79.6 -70.59 0.5 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.444 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.75 -22.05 59.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.555 -178.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.479 ' O ' ' HG2' ' A' ' 86' ' ' GLN . 0.2 OUTLIER -74.58 -44.85 48.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.076 -179.577 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -80.02 -47.61 14.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.206 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -84.0 38.3 0.64 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.394 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.762 ' HB2' ' HB ' ' A' ' 89' ' ' VAL . 2.2 pt20 -73.7 110.48 8.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.998 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.8 -67.42 0.85 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.883 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -74.61 -5.06 40.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.034 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.762 ' HB ' ' HB2' ' A' ' 86' ' ' GLN . 2.8 t -98.24 144.95 10.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.926 179.815 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -102.28 -174.66 2.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.954 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -96.3 85.93 4.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.918 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -89.8 24.28 2.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.109 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 1.4 p -111.6 21.69 15.85 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.899 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -86.86 -70.97 1.3 Allowed Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.514 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 3.4 t -107.51 130.31 23.01 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 120.61 0.243 . . . . 0.0 110.863 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -61.91 118.09 4.96 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.444 2.096 . . . . 0.0 112.287 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 21.7 p -95.5 32.21 1.84 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.893 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 6.6 m . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.091 -0.956 . . . . 0.0 111.009 179.948 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 7.5 t . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.82 0.343 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.1 p -92.22 138.27 20.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.969 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 2.4 ttmm -94.29 101.45 13.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.794 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.19 -171.56 3.16 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.015 -179.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' ASN . . . . . 0.545 ' HB2' HG12 ' A' ' 75' ' ' VAL . 9.7 m120 -115.6 -81.27 0.61 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.015 -179.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 14.2 mt -64.0 -76.51 0.07 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.765 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . 0.536 ' ND2' ' HB2' ' A' ' 49' ' ' GLU . 2.0 t30 -76.62 126.57 85.87 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.669 179.066 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.491 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 4.6 Cg_exo -74.61 -4.46 15.45 Favored 'Trans proline' 0 N--CA 1.46 -0.476 0 C-N-CA 122.307 2.005 . . . . 0.0 112.037 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' ASN . . . . . 0.416 ' H ' HD22 ' B' ' 7' ' ' ASN . 95.7 m-20 -123.65 54.8 1.28 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.022 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . 0.522 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.27 92.09 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.441 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.449 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 0.1 OUTLIER -109.47 165.76 11.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.628 179.137 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . 0.606 ' HG2' ' NZ ' ' A' ' 42' ' ' LYS . 1.8 tm-20 -67.85 165.07 18.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.65 179.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' PHE . . . . . 0.514 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.1 t80 -88.43 102.13 14.59 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.978 0.418 . . . . 0.0 110.635 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 45.5 t -109.49 92.88 12.59 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.033 178.405 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -55.68 -165.28 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 123.072 2.514 . . . . 0.0 113.063 -178.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . 0.432 ' C ' ' HE3' ' A' ' 21' ' ' LYS . . . 85.48 -52.12 4.58 Favored Glycine 0 N--CA 1.452 -0.261 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.323 -179.235 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 12.7 m -115.66 143.07 26.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.75 0.31 . . . . 0.0 111.013 179.174 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.722 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -61.66 97.12 0.07 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.725 179.849 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.29 125.67 25.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.932 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 85.5 34.63 13.43 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.417 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . 0.403 ' ND2' ' HG3' ' B' ' 18' ' ' LYS . 11.8 t30 -98.8 23.26 9.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.756 0.312 . . . . 0.0 111.023 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 12.2 pt . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.181 -0.914 . . . . 0.0 111.192 -179.843 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.189 0 CA-C-O 120.148 -0.251 . . . . 0.0 112.589 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -74.14 151.56 97.14 Favored 'Cis proline' 0 C--N 1.348 0.513 0 C-N-CA 123.318 -1.534 . . . . 0.0 112.439 0.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.448 ' H ' ' HG ' ' A' ' 3' ' ' LEU . 0.2 OUTLIER -98.64 74.69 2.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.887 179.84 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -100.37 123.76 8.03 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.535 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.408 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 36.2 t -81.89 139.65 46.6 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 120.574 0.226 . . . . 0.0 110.936 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 5' ' ' SER . 43.4 Cg_exo -56.81 -31.12 87.55 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.61 2.207 . . . . 0.0 112.229 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.487 ' O ' ' HG3' ' A' ' 11' ' ' MET . 1.0 OUTLIER -82.39 86.73 6.67 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.964 -179.744 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.76 HG21 ' HB3' ' A' ' 29' ' ' PHE . 10.5 t -88.01 -30.91 19.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.382 -179.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.36 -37.24 77.39 Favored 'General case' 0 N--CA 1.455 -0.225 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 177.201 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -70.72 -35.6 72.8 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.905 177.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.735 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 10.9 mtm -64.17 -36.85 85.42 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 177.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.66 HD11 ' HB3' ' A' ' 24' ' ' LEU . 1.4 mp -51.69 -52.43 48.31 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.975 179.047 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.45 -33.27 75.33 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.307 178.462 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.51 30.91 4.0 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.908 -178.118 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.451 ' HB1' ' CB ' ' A' ' 19' ' ' GLU . . . -147.24 120.21 4.85 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.044 179.18 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.471 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 19.6 Cg_endo -59.26 168.81 4.42 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.567 2.178 . . . . 0.0 111.82 179.1 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -58.05 -29.68 87.73 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.394 2.063 . . . . 0.0 112.158 179.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.46 -11.28 60.41 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.133 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.531 ' HA ' ' OE1' ' A' ' 19' ' ' GLU . 0.7 OUTLIER -88.5 12.2 15.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.792 -179.832 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.596 HE22 ' HB3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -46.73 -66.76 0.36 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.054 -0.521 . . . . 0.0 112.11 -177.568 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.733 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -56.74 -19.17 15.46 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -177.372 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.639 ' N ' ' HD2' ' A' ' 21' ' ' LYS . 1.8 tt0 -72.72 -78.05 0.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.911 0.386 . . . . 0.0 111.294 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.626 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.47 -97.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.419 -177.074 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.66 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -61.79 -1.04 0.54 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -175.836 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 65.1 -115.84 8.21 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 108.463 -1.855 . . . . 0.0 108.463 -174.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.42 ' O ' HD13 ' A' ' 24' ' ' LEU . 0.4 OUTLIER -76.06 -69.54 0.49 Allowed 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 169.447 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.837 ' HG3' HD21 ' A' ' 31' ' ' LEU . 6.3 tpt180 -159.63 12.21 0.13 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 114.309 -1.314 . . . . 0.0 108.107 176.622 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.593 HD12 HD11 ' A' ' 32' ' ' ILE . 3.8 mm? -57.76 -84.14 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.44 -1.255 . . . . 0.0 113.923 -173.412 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.76 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -32.66 -51.53 0.61 Allowed Pre-proline 0 CA--C 1.535 0.392 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -174.977 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.57 ' HG2' ' O ' ' A' ' 27' ' ' ARG . 10.0 Cg_endo -56.03 -41.98 71.32 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.479 2.119 . . . . 0.0 113.787 -177.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.837 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.61 -48.81 53.27 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 120.019 -0.672 . . . . 0.0 109.748 -179.427 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.837 HG21 HD12 ' A' ' 43' ' ' ILE . 0.7 OUTLIER -72.17 -13.51 16.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.304 178.578 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.647 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 1.8 tp-100 -62.41 -40.01 95.15 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 177.312 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.71 -29.92 70.02 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.227 -0.897 . . . . 0.0 108.882 174.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.471 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 6.8 mtt -101.65 25.61 8.3 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.399 177.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.8 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 0.1 OUTLIER -64.07 -32.76 8.09 Favored Pre-proline 0 CA--C 1.536 0.429 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 -177.271 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.8 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 4.0 Cg_exo -36.21 -32.74 0.11 Allowed 'Trans proline' 0 C--N 1.364 1.343 0 C-N-CA 122.498 2.132 . . . . 0.0 112.099 179.33 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 1.006 HG21 HG13 ' A' ' 73' ' ' VAL . 0.2 OUTLIER -78.23 -87.23 0.06 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.898 176.83 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.533 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.3 OUTLIER -171.29 59.97 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.371 178.388 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.503 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -48.64 -31.36 6.6 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 120.894 0.378 . . . . 0.0 111.309 179.475 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.647 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -44.43 -63.99 2.21 Favored Glycine 0 N--CA 1.453 -0.225 0 CA-C-N 115.684 -0.689 . . . . 0.0 114.372 -178.505 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.563 ' HE3' ' HG3' ' B' ' 12' ' ' GLU . 0.0 OUTLIER -77.79 -29.61 50.93 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -176.999 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.918 HD11 HD11 ' A' ' 76' ' ' LEU . 15.9 mt -53.88 -53.92 23.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.467 -178.622 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.555 HG21 ' CD2' ' A' ' 29' ' ' PHE . 6.7 t -47.14 -46.6 23.36 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.143 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.64 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -53.44 -61.06 7.37 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.917 -0.583 . . . . 0.0 113.022 179.304 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.575 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.45 -52.6 63.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.665 0.269 . . . . 0.0 111.492 -178.516 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.582 HD11 ' HB3' ' B' ' 6' ' ' LEU . 3.0 mm? -80.04 5.72 13.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.685 -178.327 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.474 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.0 -16.58 64.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.837 0.351 . . . . 0.0 110.717 179.57 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' B' ' 9' ' ' ASN . 3.4 mm-40 -76.65 18.84 0.3 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.807 179.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.43 ' H ' ' C ' ' A' ' 48' ' ' LEU . 0.4 OUTLIER -83.23 161.3 3.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.528 179.89 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.55 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 6.3 m-20 -70.49 155.51 40.61 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.98 0.419 . . . . 0.0 111.51 -178.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.887 ' HA ' HD23 ' A' ' 55' ' ' LEU . 5.1 m120 -83.33 -30.95 27.08 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.323 178.544 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.2 t -74.04 -33.7 63.82 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.302 0.572 . . . . 0.0 109.521 177.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.55 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -77.96 -24.93 47.95 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.552 179.445 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.887 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -60.28 -48.11 83.15 Favored 'General case' 0 C--O 1.231 0.121 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 178.461 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.431 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 2.0 tm? -58.71 -39.88 82.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.094 178.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.49 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 12.9 t-80 -60.19 -40.21 89.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.543 178.707 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.563 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -62.21 -41.65 98.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.073 0.463 . . . . 0.0 110.309 178.815 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.649 HD12 ' CZ ' ' A' ' 27' ' ' ARG . 8.1 tt -67.19 -19.51 65.58 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.7 178.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 57' ' ' HIS . 5.2 pt-20 -105.03 -6.6 19.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.52 -178.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.564 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.3 OUTLIER -123.0 86.79 50.94 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.139 -179.69 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.467 ' O ' ' HB2' ' A' ' 66' ' ' ARG . 23.9 Cg_endo -61.3 -30.13 87.3 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.18 1.92 . . . . 0.0 111.863 179.038 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -78.09 -51.13 10.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.436 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.415 ' O ' ' HB2' ' A' ' 67' ' ' SER . 66.9 m -69.83 -50.43 42.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.633 -178.307 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.827 HD21 HD13 ' A' ' 31' ' ' LEU . 0.0 OUTLIER -58.03 -59.77 4.75 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.282 -178.626 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.63 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -51.78 -30.27 22.31 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.618 -178.635 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.57 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 2.5 m -67.36 -37.71 83.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.314 178.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.459 ' HE3' ' OE2' ' A' ' 54' ' ' GLU . 3.2 mtmm -65.72 -59.33 4.02 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.164 178.516 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.567 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 74.9 t -62.75 -18.71 21.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.58 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.57 ' HB3' ' O ' ' A' ' 67' ' ' SER . 7.3 t70 -56.92 -48.82 77.35 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 176.2 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.41 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 43.8 tt0 -67.87 -29.31 68.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.628 176.24 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.805 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -59.27 -42.74 91.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.341 178.45 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 1.006 HG13 HG21 ' A' ' 38' ' ' THR . 14.6 t -60.73 -30.52 47.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 176.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -73.52 -31.88 63.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.056 178.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.73 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.1 m -61.0 -30.02 46.81 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.084 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 179.234 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.918 HD11 HD11 ' A' ' 43' ' ' ILE . 76.2 mt -65.94 -56.67 10.54 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 121.233 0.54 . . . . 0.0 109.942 177.227 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 21.2 mm100 -51.02 -36.11 37.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.026 -0.988 . . . . 0.0 110.591 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.81 -27.54 33.6 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.042 178.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.595 ' HB2' ' O ' ' A' ' 75' ' ' VAL . 0.9 OUTLIER -74.96 -23.0 58.22 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.196 -179.337 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -73.31 5.84 3.32 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.209 -179.474 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -80.51 -77.41 0.2 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.532 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -80.22 -24.78 39.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.758 -178.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.563 ' HB3' ' O ' ' A' ' 79' ' ' HIS . 37.3 tp10 -74.35 -31.9 62.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.585 -0.28 . . . . 0.0 111.245 -178.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -69.69 -4.11 18.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.373 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -69.84 -16.77 63.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.083 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 13.5 mt-30 -77.0 -67.02 0.75 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.928 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.39 88.26 3.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.818 179.705 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -82.5 -4.54 57.69 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.227 -179.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.5 p -79.68 96.18 2.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.039 0.447 . . . . 0.0 110.852 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -104.4 116.55 32.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.989 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.52 60.64 5.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.711 179.599 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.46 104.27 0.49 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.176 -179.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 8.2 t -98.29 -24.72 15.12 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.878 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -93.41 -118.03 2.71 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.539 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -106.89 135.95 19.5 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.678 0.275 . . . . 0.0 110.866 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.43 -155.95 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.559 2.173 . . . . 0.0 112.327 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.52 -68.73 0.59 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.905 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.084 -0.96 . . . . 0.0 110.998 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.815 0.341 . . . . 0.0 110.953 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 22.4 t -89.83 91.88 3.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.985 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.96 136.89 35.24 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.081 -179.602 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -93.29 -165.69 1.38 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.918 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 -106.86 -80.66 0.56 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.832 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.582 ' HB3' HD11 ' A' ' 47' ' ' LEU . 9.7 tp -62.82 -81.36 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.769 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . 0.673 HD22 ' H ' ' B' ' 9' ' ' ASN . 1.3 t30 -78.75 130.03 71.92 Favored Pre-proline 0 C--N 1.332 -0.194 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.706 178.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.93 1.38 8.95 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.107 1.871 . . . . 0.0 112.108 179.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' ASN . . . . . 0.673 ' H ' HD22 ' B' ' 7' ' ' ASN . 17.2 m-80 -123.52 46.71 2.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.918 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . 0.575 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.27 95.82 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.573 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.425 ' HG3' ' O ' ' B' ' 9' ' ' ASN . 1.0 OUTLIER -121.49 170.46 9.64 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.502 178.949 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . 0.563 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 2.3 tt0 -68.06 163.8 21.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.795 0.331 . . . . 0.0 111.03 179.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 13' ' ' PHE . . . . . 0.64 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.2 t80 -92.32 112.52 24.49 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.152 -179.545 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -112.63 91.24 16.68 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.539 178.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 15' ' ' PRO . . . . . 0.546 ' HB3' ' HA ' ' A' ' 22' ' ' GLN . 50.6 Cg_exo -55.22 -175.55 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.695 2.264 . . . . 0.0 112.998 -178.747 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . 0.418 ' C ' ' HD3' ' A' ' 21' ' ' LYS . . . 85.28 -49.42 4.2 Favored Glycine 0 N--CA 1.452 -0.278 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.678 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 2.6 m -115.61 141.51 32.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.87 0.367 . . . . 0.0 111.246 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.733 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -62.32 100.98 0.2 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.954 -179.889 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -75.85 119.91 20.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.004 -179.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.14 86.06 0.22 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.43 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -88.63 -90.72 0.13 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.839 0.352 . . . . 0.0 111.016 -179.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.328 -0.844 . . . . 0.0 111.058 -179.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.296 0 N-CA-C 112.414 -0.274 . . . . 0.0 112.414 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -59.75 -24.51 76.0 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.556 2.17 . . . . 0.0 112.142 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.74 102.87 2.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.86 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.415 ' O ' ' HD3' ' A' ' 6' ' ' PRO . . . -88.02 95.62 2.1 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.563 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -87.02 110.61 34.4 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-O 120.518 0.199 . . . . 0.0 111.02 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.453 ' HB2' ' HB2' ' A' ' 10' ' ' SER . 44.5 Cg_exo -57.19 118.52 5.4 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.649 2.232 . . . . 0.0 112.25 -179.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.417 ' O ' ' HG3' ' A' ' 11' ' ' MET . 1.1 mt -96.85 -69.6 0.75 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.968 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.796 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 10.8 t -87.99 -28.1 21.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.521 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.517 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.46 -38.26 80.31 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 176.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.453 ' HB2' ' HB2' ' A' ' 6' ' ' PRO . 10.7 t -71.13 -34.35 70.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.608 177.184 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.796 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 5.3 mtm -64.36 -33.92 76.96 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 177.139 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.759 HD12 ' SD ' ' A' ' 23' ' ' MET . 3.7 mp -52.79 -54.66 30.89 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.891 178.421 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.32 -25.92 67.06 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.242 178.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.1 m -101.66 14.02 33.2 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.963 -178.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.632 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -134.76 118.05 13.22 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 120.515 0.198 . . . . 0.0 111.281 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.443 ' HD2' ' OE1' ' A' ' 19' ' ' GLU . 47.3 Cg_exo -56.36 167.34 2.72 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.628 2.218 . . . . 0.0 112.008 179.39 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -54.29 -37.47 88.47 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.395 2.064 . . . . 0.0 112.366 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -72.21 -18.63 61.83 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.929 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.632 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.9 OUTLIER -85.1 16.01 3.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.92 179.885 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.486 ' O ' HD12 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -60.87 -49.44 77.48 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.354 179.626 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.566 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -56.88 -21.74 31.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.255 -179.82 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.566 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 12.5 tp60 -73.84 -80.49 0.07 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.035 0.445 . . . . 0.0 111.641 179.562 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.759 ' SD ' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -70.05 -94.87 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -176.032 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.605 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -58.91 0.96 0.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -174.993 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.411 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . 64.83 -117.13 9.87 Favored Glycine 0 N--CA 1.444 -0.791 0 N-CA-C 108.342 -1.903 . . . . 0.0 108.342 -174.488 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' A' ' 51' ' ' ASP . 2.2 mp0 -76.06 -69.12 0.52 Allowed 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 169.083 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.846 ' HB2' HD13 ' A' ' 55' ' ' LEU . 1.7 tpt180 -159.99 9.27 0.1 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.259 -1.337 . . . . 0.0 107.939 175.065 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.969 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.59 -69.78 0.19 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 114.308 -1.315 . . . . 0.0 113.561 -173.61 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.588 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -37.93 -49.0 3.02 Favored Pre-proline 0 CA--C 1.538 0.503 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -175.847 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.599 ' HG2' ' HD2' ' A' ' 27' ' ' ARG . 46.5 Cg_exo -58.97 -43.89 39.52 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 122.37 2.046 . . . . 0.0 113.505 -178.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.609 HD13 ' CD1' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.89 -46.02 63.32 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.216 -178.313 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.852 HD11 HD23 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -74.96 -12.61 15.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.166 178.087 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.636 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -62.09 -39.77 93.57 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 176.557 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.46 -31.77 72.16 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.058 174.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.518 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 6.4 mtt -100.23 27.42 5.66 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.394 178.185 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.636 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 2.0 p-80 -65.31 -31.99 5.8 Favored Pre-proline 0 CA--C 1.536 0.431 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 -177.383 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.581 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 47.5 Cg_exo -35.78 -32.53 0.1 OUTLIER 'Trans proline' 0 C--N 1.361 1.209 0 C-N-CA 122.278 1.985 . . . . 0.0 112.597 179.709 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.405 ' HB ' ' H ' ' A' ' 39' ' ' LEU . 16.9 m -78.28 -83.27 0.09 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.131 177.144 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.516 HD12 ' HB2' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -171.09 52.77 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.201 178.828 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.485 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -38.33 -42.54 0.72 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.97 -179.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.588 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -52.73 -49.44 53.62 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 121.046 -0.597 . . . . 0.0 113.641 -178.706 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.953 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.1 OUTLIER -77.05 -36.7 55.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 117.061 0.431 . . . . 0.0 111.616 -178.491 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.72 HD12 HG21 ' A' ' 32' ' ' ILE . 0.4 OUTLIER -53.63 -62.62 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.724 0.297 . . . . 0.0 110.721 -179.846 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.969 ' HA ' HD22 ' A' ' 28' ' ' LEU . 8.9 t -48.56 -44.11 36.26 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.261 178.622 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.881 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -48.12 -67.79 1.47 Allowed Glycine 0 C--O 1.227 -0.289 0 CA-C-N 115.655 -0.702 . . . . 0.0 113.201 179.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.501 ' HA ' ' C ' ' B' ' 11' ' ' LYS . 0.0 OUTLIER -54.68 -56.83 14.97 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.797 0.295 . . . . 0.0 111.797 -178.057 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.861 HD23 ' HB2' ' B' ' 7' ' ' ASN . 2.8 mp -79.99 17.42 0.98 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 -177.683 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.639 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.72 -18.09 65.19 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.121 0.486 . . . . 0.0 109.871 177.044 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.601 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.1 mt-10 -74.65 19.96 0.13 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.335 179.513 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.435 ' H ' ' C ' ' A' ' 48' ' ' LEU . 1.8 tt -83.29 162.74 3.11 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-O 120.828 0.347 . . . . 0.0 110.959 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.487 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 1.1 m-20 -71.18 154.73 41.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.102 -0.499 . . . . 0.0 112.288 -178.298 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.766 ' HA ' HD23 ' A' ' 55' ' ' LEU . 1.8 m120 -82.54 -27.39 31.68 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.551 176.192 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -74.19 -32.91 63.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.805 177.585 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.4 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 4.5 mt-10 -75.71 -28.7 58.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.419 178.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.846 HD13 ' HB2' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -59.84 -46.94 87.7 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.149 179.288 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.406 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -57.57 -48.6 78.89 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.505 179.255 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.405 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 0.3 OUTLIER -57.26 -40.12 77.01 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.865 179.776 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.565 ' SD ' ' HE2' ' A' ' 68' ' ' LYS . 12.9 mmt -64.41 -41.55 96.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.01 0.434 . . . . 0.0 110.294 179.104 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.454 HD12 ' NE ' ' A' ' 27' ' ' ARG . 4.9 tt -69.39 -14.99 63.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.78 179.712 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.405 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 0.0 OUTLIER -106.58 -9.12 16.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.35 -179.751 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.649 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -123.22 85.65 51.59 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.934 -179.678 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_endo -61.34 -33.1 89.76 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.295 1.997 . . . . 0.0 112.173 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.32 -46.36 20.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.463 -179.429 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 30.8 m -70.22 -48.39 57.26 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.859 0.361 . . . . 0.0 111.316 -178.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.65 ' HG ' ' N ' ' A' ' 66' ' ' ARG . 0.1 OUTLIER -58.01 -58.57 7.82 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.749 -178.937 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.65 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -50.9 -34.07 26.87 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.241 -177.625 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.54 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 35.3 t -63.41 -41.95 98.75 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.118 0.485 . . . . 0.0 110.153 178.246 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.565 ' HE2' ' SD ' ' A' ' 58' ' ' MET . 1.0 OUTLIER -66.21 -57.32 7.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.686 179.285 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.553 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 71.1 t -63.36 -19.08 23.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.775 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.638 ' O ' HG22 ' A' ' 73' ' ' VAL . 7.5 t70 -56.97 -48.85 77.42 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 176.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.518 ' HB3' HD12 ' B' ' 6' ' ' LEU . 0.8 OUTLIER -68.87 -25.54 64.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.843 176.56 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.688 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -61.18 -48.78 79.99 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.845 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.658 ' HA ' HD13 ' A' ' 43' ' ' ILE . 2.6 m -58.68 -30.14 41.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 177.334 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.51 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -69.08 -37.98 78.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.287 -0.869 . . . . 0.0 111.196 179.331 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.549 HG22 ' O ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -57.31 -29.02 31.8 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 178.664 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.953 HD11 ' HB3' ' A' ' 42' ' ' LYS . 3.9 mm? -72.0 -50.7 26.47 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.073 177.081 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -51.38 -31.25 21.73 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.241 -0.891 . . . . 0.0 109.697 178.294 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.47 -30.09 33.51 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.581 177.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 2.7 t-160 -59.28 -20.26 52.93 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.636 179.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.861 ' HA ' ' HG2' ' A' ' 83' ' ' GLU . 5.4 mt-30 -72.79 6.07 2.78 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.415 -179.494 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.65 -70.05 0.54 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.201 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 8.0 mptt -80.32 -21.55 42.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.597 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.861 ' HG2' ' HA ' ' A' ' 80' ' ' GLN . 0.7 OUTLIER -74.35 -35.7 63.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.888 0.375 . . . . 0.0 111.387 -178.758 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -72.36 6.97 1.98 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.568 -179.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.89 -32.61 74.19 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.988 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -79.85 173.44 12.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.004 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.52 -1.72 56.74 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.977 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -89.41 26.88 1.57 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.092 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 5.4 p -96.44 7.77 7.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.904 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -89.89 50.19 1.84 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.062 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -83.09 172.68 12.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.798 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -79.01 89.73 4.78 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.941 179.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 72.2 p -117.6 110.88 18.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.005 -179.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -90.21 2.72 81.66 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.401 179.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 8.8 t -90.25 133.02 34.1 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-O 120.344 0.116 . . . . 0.0 110.954 -179.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.466 ' HG2' ' H ' ' A' ' 97' ' ' THR . 73.5 Cg_endo -78.09 -63.48 0.03 OUTLIER 'Cis proline' 0 C--N 1.349 0.565 0 C-N-CA 123.557 -1.434 . . . . 0.0 112.758 0.778 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.466 ' H ' ' HG2' ' A' ' 96' ' ' PRO . 4.8 t -107.98 -21.86 12.65 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.046 -179.585 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.6 m . . . . . 0 C--O 1.249 1.064 0 CA-C-O 117.965 -1.017 . . . . 0.0 111.111 -179.882 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.418 0 CA-C-O 120.604 0.24 . . . . 0.0 110.758 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 21.0 m -79.28 149.36 5.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.078 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.76 117.43 27.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.964 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 2.0 m -86.69 -175.54 5.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.687 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -103.98 -43.32 5.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.997 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.518 HD12 ' HB3' ' A' ' 71' ' ' GLU . 0.8 OUTLIER -80.62 -81.43 0.13 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.84 -179.982 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . 0.861 ' HB2' HD23 ' A' ' 47' ' ' LEU . 2.1 t30 -81.47 122.82 81.22 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.757 179.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -78.54 9.88 3.02 Favored 'Trans proline' 0 N--CA 1.459 -0.517 0 C-N-CA 122.16 1.906 . . . . 0.0 112.034 179.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' ASN . . . . . 0.519 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 56.5 m-20 -123.25 34.33 5.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.034 -179.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.77 90.01 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.654 -179.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.601 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 1.9 mttm -129.1 138.56 51.91 Favored 'General case' 0 C--O 1.226 -0.179 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.132 178.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -46.58 163.04 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -177.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 13' ' ' PHE . . . . . 0.881 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.7 OUTLIER -87.28 82.28 7.66 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.786 179.433 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.581 ' H ' ' CD ' ' B' ' 15' ' ' PRO . 1.7 m -118.15 -43.0 0.05 OUTLIER Pre-proline 0 CA--C 1.539 0.542 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -176.532 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 15' ' ' PRO . . . . . 0.581 ' CD ' ' H ' ' B' ' 14' ' ' VAL . 86.2 Cg_exo -45.64 -39.67 18.05 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 122.262 1.975 . . . . 0.0 112.894 -178.59 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 77.78 -22.63 2.76 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.219 -179.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.717 HG22 ' H ' ' B' ' 18' ' ' LYS . 1.8 p -94.97 -176.37 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 110.373 -0.232 . . . . 0.0 110.373 179.27 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.717 ' H ' HG22 ' B' ' 17' ' ' VAL . 5.0 mttm -59.86 94.01 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.906 0.384 . . . . 0.0 110.825 -179.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.466 ' HD1' ' HA ' ' B' ' 19' ' ' TYR . 0.1 OUTLIER -84.75 117.97 24.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.83 -179.679 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 79.33 47.56 7.37 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.823 -0.704 . . . . 0.0 112.529 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -95.27 -0.02 53.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.811 0.339 . . . . 0.0 110.883 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . 0.447 ' N ' HD13 ' B' ' 22' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.174 -0.917 . . . . 0.0 111.019 179.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.113 0 N-CA-C 112.496 -0.242 . . . . 0.0 112.496 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -74.5 -20.25 18.31 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.508 2.139 . . . . 0.0 112.425 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.43 179.41 7.81 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.048 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -91.28 -68.69 1.17 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.567 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.25 133.71 31.13 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-O 120.598 0.237 . . . . 0.0 110.906 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.13 -166.81 0.21 Allowed 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.441 2.094 . . . . 0.0 112.223 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.439 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.3 OUTLIER -81.1 122.92 27.94 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.964 -179.985 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.794 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 8.2 t -87.87 -28.85 21.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.372 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.452 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.43 -39.24 82.87 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 176.418 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 39.3 t -68.94 -33.1 73.17 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.454 176.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.794 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.2 mtm -64.13 -34.86 79.01 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.818 177.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.502 HD11 ' HB3' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -55.25 -49.96 70.69 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.329 178.684 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.05 -32.41 73.86 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.611 178.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.1 m -101.38 46.67 0.93 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.76 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.845 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -131.97 -39.84 0.03 OUTLIER Pre-proline 0 CA--C 1.537 0.447 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 -178.027 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.74 ' HD2' ' H ' ' A' ' 15' ' ' ALA . 92.2 Cg_exo -46.85 141.26 12.0 Favored 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 121.674 1.583 . . . . 0.0 112.038 -178.448 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.71 ' O ' ' HA ' ' A' ' 16' ' ' PRO . 16.7 Cg_exo -71.12 -140.49 0.16 OUTLIER 'Cis proline' 0 C--N 1.354 0.826 0 C-N-CA 124.498 -1.043 . . . . 0.0 114.209 3.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -52.85 77.64 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 -176.616 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.845 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 2.1 tp10 -106.59 13.83 27.77 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.879 175.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.464 ' HA ' HD11 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -46.25 -56.31 5.95 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.672 -177.512 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.519 ' H ' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -56.02 -24.3 38.37 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.506 -178.342 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.475 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 17.1 tp60 -73.6 -78.45 0.09 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.908 0.385 . . . . 0.0 111.838 179.398 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.587 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -68.96 -97.29 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 112.997 0.74 . . . . 0.0 112.997 -175.93 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.587 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -57.03 0.34 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.275 0 N-CA-C 113.51 0.929 . . . . 0.0 113.51 -175.519 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.419 ' H ' ' C ' ' A' ' 23' ' ' MET . . . 64.79 -117.19 9.99 Favored Glycine 0 CA--C 1.505 -0.594 0 N-CA-C 108.269 -1.932 . . . . 0.0 108.269 -174.685 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.535 ' HG2' HG22 ' A' ' 50' ' ' ILE . 0.4 OUTLIER -75.56 -68.27 0.58 Allowed 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 168.089 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.832 ' HE ' HD13 ' A' ' 59' ' ' LEU . 1.1 tpt180 -160.52 8.42 0.09 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.151 -1.386 . . . . 0.0 107.999 174.37 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.955 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.23 -73.96 0.08 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.551 -1.204 . . . . 0.0 113.896 -172.921 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.578 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.2 OUTLIER -36.79 -49.79 1.99 Allowed Pre-proline 0 CA--C 1.536 0.431 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -175.336 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.602 ' HG2' ' O ' ' A' ' 27' ' ' ARG . 12.4 Cg_endo -58.95 -41.69 59.41 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 121.975 1.783 . . . . 0.0 113.128 -178.053 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.637 HD13 ' CD1' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -71.06 -45.44 63.79 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 120.339 -0.545 . . . . 0.0 110.182 -179.663 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.642 HD11 HD23 ' A' ' 28' ' ' LEU . 0.8 OUTLIER -71.56 -17.27 19.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.313 -0.403 . . . . 0.0 109.933 177.59 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.643 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 2.0 tt0 -63.26 -32.51 73.93 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 176.455 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.5 -29.64 65.04 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.679 -0.859 . . . . 0.0 108.679 175.02 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.427 ' HE1' ' HB ' ' A' ' 69' ' ' VAL . 8.9 mtt -100.08 19.67 15.91 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 114.84 -1.073 . . . . 0.0 109.72 177.242 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.643 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.6 OUTLIER -63.81 -34.8 13.25 Favored Pre-proline 0 CA--C 1.532 0.263 0 CA-C-N 115.511 -0.768 . . . . 0.0 112.106 -178.636 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.542 ' CD ' ' N ' ' A' ' 36' ' ' HIS . 87.4 Cg_exo -42.18 -26.22 0.5 Allowed 'Trans proline' 0 C--N 1.361 1.191 0 C-N-CA 121.769 1.646 . . . . 0.0 111.066 177.323 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 1.081 HG21 HG13 ' A' ' 73' ' ' VAL . 86.8 m -77.99 -80.95 0.1 Allowed 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.325 -0.852 . . . . 0.0 109.556 176.089 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.612 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -171.63 52.51 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 112.608 0.595 . . . . 0.0 112.608 178.61 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -56.86 149.51 18.33 Favored 'General case' 0 C--O 1.231 0.127 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 176.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.578 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . 132.57 -73.41 0.46 Allowed Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.566 -178.364 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.56 -28.17 51.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.698 0.285 . . . . 0.0 111.043 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.627 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 55.2 mt -54.05 -53.77 25.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.795 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.955 ' HA ' HD22 ' A' ' 28' ' ' LEU . 13.1 t -54.25 -37.02 64.21 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.827 0.346 . . . . 0.0 110.538 178.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.857 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -48.12 -70.5 0.73 Allowed Glycine 0 N--CA 1.45 -0.418 0 CA-C-N 115.745 -0.661 . . . . 0.0 113.119 -179.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.473 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.36 -45.67 76.48 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -178.127 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.47 HD11 ' HB3' ' B' ' 6' ' ' LEU . 3.1 mm? -79.91 7.7 8.36 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -177.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.616 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.34 -7.38 18.6 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.881 0.372 . . . . 0.0 110.853 179.556 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.41 ' OE1' ' HG3' ' B' ' 11' ' ' LYS . 1.2 mm-40 -85.65 18.55 2.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.807 179.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.535 HG22 ' HG2' ' A' ' 26' ' ' GLU . 0.8 OUTLIER -83.72 162.63 3.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.861 -179.684 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.51 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 21.3 m-20 -70.96 157.58 37.95 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.902 0.382 . . . . 0.0 111.778 -178.506 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.928 ' HA ' HD23 ' A' ' 55' ' ' LEU . 3.1 m120 -87.07 -29.87 21.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.91 -0.587 . . . . 0.0 109.971 177.72 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.1 -30.51 62.37 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 177.094 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.51 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -78.38 -27.41 46.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.59 179.058 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.928 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.8 OUTLIER -61.6 -47.07 87.14 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.473 179.98 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 58.1 tp -61.9 -43.85 98.01 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.946 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -60.2 -28.48 68.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.443 -179.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.55 ' HB3' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -68.39 -51.07 48.13 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.529 -179.076 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.832 HD13 ' HE ' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -63.58 -20.24 65.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.194 -179.303 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -95.53 -5.84 41.84 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.02 0.438 . . . . 0.0 110.496 178.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.631 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 5.1 m -122.69 79.46 48.27 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.631 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -55.29 -34.57 88.95 Favored 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 122.36 2.04 . . . . 0.0 112.178 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -78.41 -49.34 13.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.945 -179.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.534 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 15.7 m -69.2 -45.96 68.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.961 0.41 . . . . 0.0 111.39 -178.029 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.637 ' CD1' HD13 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -59.46 -61.49 2.59 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.774 -178.558 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.627 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -50.78 -31.76 17.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.208 -177.538 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.531 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 20.7 t -63.86 -42.76 97.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.11 0.481 . . . . 0.0 110.276 178.346 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.404 ' HG2' HD21 ' B' ' 6' ' ' LEU . 6.3 ttmm -66.31 -58.12 6.01 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.853 179.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.478 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 79.3 t -62.37 -20.78 25.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.616 179.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.531 ' HB3' ' O ' ' A' ' 67' ' ' SER . 9.6 t0 -54.71 -49.08 71.59 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 176.343 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.507 ' HG2' ' HB3' ' B' ' 5' ' ' ASN . 0.5 OUTLIER -68.88 -29.48 67.79 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.847 176.495 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.627 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -60.44 -38.01 82.74 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.087 178.068 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 1.081 HG13 HG21 ' A' ' 38' ' ' THR . 3.6 t -64.74 -29.35 47.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 176.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.446 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -73.15 -38.94 66.06 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.251 179.375 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.568 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.07 -30.34 38.79 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-O 121.127 0.489 . . . . 0.0 110.086 179.343 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.612 ' HG ' ' HB3' ' A' ' 39' ' ' LEU . 3.0 tm? -71.19 -52.78 17.18 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.209 178.689 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -55.99 -34.52 65.85 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.614 179.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.01 -23.04 38.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.787 179.045 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.6 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 19.3 t60 -70.23 -49.21 52.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.86 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -71.48 -5.25 31.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.18 -179.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -64.06 -66.89 0.48 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.962 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.4 -15.69 57.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.83 179.711 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.6 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 1.8 tm-20 -76.82 -26.04 53.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.029 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -68.24 -16.75 64.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.126 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.35 -31.52 72.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.044 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -93.25 -30.7 15.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.942 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.4 ttmt -83.67 114.83 21.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.972 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -80.43 83.82 6.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.986 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -85.19 155.88 3.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.035 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -74.48 176.67 6.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.91 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.2 5.15 23.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.052 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -90.0 84.5 6.18 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.11 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 16.5 p -104.69 119.31 38.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.901 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -103.04 49.29 0.97 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.511 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.53 ' N ' ' HD2' ' A' ' 96' ' ' PRO . 11.4 t -81.37 -51.21 0.89 Allowed Pre-proline 0 C--N 1.329 -0.312 0 N-CA-C 111.553 0.205 . . . . 0.0 111.553 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.53 ' HD2' ' N ' ' A' ' 95' ' ' VAL . 39.3 Cg_endo -66.78 134.37 34.68 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 122.19 1.927 . . . . 0.0 112.238 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 32.4 p -89.14 40.18 0.97 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.01 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.053 -0.975 . . . . 0.0 111.047 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 3.4 t . . . . . 0 N--CA 1.486 1.325 0 CA-C-O 120.764 0.316 . . . . 0.0 110.921 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . 0.623 HG11 ' HB3' ' B' ' 10' ' ' ALA . 12.2 t -81.72 139.73 17.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.076 -179.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 5.8 mtpt -95.16 66.56 2.95 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.895 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . 0.502 ' HB3' ' O ' ' B' ' 7' ' ' ASN . 8.4 t -89.67 -174.98 4.51 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.846 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' ASN . . . . . 0.507 ' HB3' ' HG2' ' A' ' 71' ' ' GLU . 1.8 m-80 -104.15 -57.35 2.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.923 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.47 ' HB3' HD11 ' A' ' 47' ' ' LEU . 0.2 OUTLIER -71.27 -84.52 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.685 179.806 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . 0.502 ' O ' ' HB3' ' B' ' 4' ' ' SER . 3.2 t30 -78.41 139.11 59.38 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.851 179.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -79.01 -9.21 15.5 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 122.328 2.018 . . . . 0.0 111.94 178.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 72.7 m-80 -123.31 57.79 1.14 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.79 179.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . 0.623 ' HB3' HG11 ' B' ' 2' ' ' VAL . . . -59.76 93.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.603 -179.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.41 ' HG3' ' OE1' ' A' ' 49' ' ' GLU . 10.2 mttp -114.02 125.19 53.71 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.337 179.038 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -48.74 168.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -177.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 13' ' ' PHE . . . . . 0.857 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.5 OUTLIER -87.78 80.25 7.93 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.07 179.159 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.531 ' H ' ' CD ' ' B' ' 15' ' ' PRO . 1.3 m -116.34 -45.07 0.05 OUTLIER Pre-proline 0 CA--C 1.539 0.53 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -176.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 15' ' ' PRO . . . . . 0.531 ' CD ' ' H ' ' B' ' 14' ' ' VAL . 80.9 Cg_exo -47.6 -40.02 30.05 Favored 'Trans proline' 0 C--N 1.354 0.854 0 C-N-CA 122.218 1.945 . . . . 0.0 112.872 -178.508 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . 0.425 ' O ' ' HD2' ' A' ' 21' ' ' LYS . . . 82.85 -26.95 4.0 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.339 -179.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 29.2 m -95.13 -172.06 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.516 0.198 . . . . 0.0 110.682 179.425 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.31 90.67 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.939 0.4 . . . . 0.0 110.674 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.425 ' CD1' ' HG2' ' B' ' 15' ' ' PRO . 0.3 OUTLIER -78.37 124.7 28.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.008 -179.427 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 93.72 40.6 4.64 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.408 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 33.5 t30 -97.22 -15.45 20.84 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.813 0.339 . . . . 0.0 110.998 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 29.7 mm . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.213 -0.899 . . . . 0.0 111.021 -179.972 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.411 ' HA2' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.489 2.231 0 CA-C-O 120.123 -0.265 . . . . 0.0 112.524 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.851 ' HB3' ' HG ' ' A' ' 7' ' ' LEU . 21.6 Cg_exo -65.64 80.61 0.25 Allowed 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.756 2.304 . . . . 0.0 112.268 -179.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -100.02 -67.18 0.86 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.926 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -107.3 -97.55 2.52 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.55 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.531 ' HB3' ' HD3' ' A' ' 6' ' ' PRO . 2.1 t -82.37 -50.73 0.79 Allowed Pre-proline 0 CA--C 1.533 0.322 0 N-CA-C 111.428 0.159 . . . . 0.0 111.428 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.531 ' HD3' ' HB3' ' A' ' 5' ' ' SER . 26.4 Cg_exo -63.45 86.13 0.13 Allowed 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.296 1.997 . . . . 0.0 112.296 -179.62 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.851 ' HG ' ' HB3' ' A' ' 2' ' ' PRO . 0.1 OUTLIER -100.85 -73.47 0.64 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.883 179.838 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.774 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 10.2 t -87.83 -33.2 18.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.223 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.466 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.48 -37.48 78.35 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 176.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.2 t -68.0 -34.73 77.08 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.739 177.307 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.774 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 12.0 mtm -64.21 -36.49 84.25 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.912 177.577 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.692 ' HA ' ' HE2' ' A' ' 23' ' ' MET . 4.1 mp -52.15 -48.68 64.77 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.117 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.03 -30.89 71.5 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.022 178.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.5 p -101.37 19.5 17.66 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.54 -178.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.579 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -135.36 119.56 13.25 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.21 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_exo -56.02 167.54 2.35 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.617 2.211 . . . . 0.0 112.051 179.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_exo -56.29 -38.19 95.53 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.454 2.102 . . . . 0.0 112.422 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -73.32 -11.42 60.49 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.129 -179.648 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.579 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.9 OUTLIER -85.79 12.44 9.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.83 -179.963 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.477 ' O ' HD12 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -52.18 -57.61 9.11 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.372 -179.77 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.538 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.9 -20.37 15.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.539 -178.608 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.568 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 5.0 tp60 -73.2 -79.46 0.08 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.873 0.368 . . . . 0.0 111.341 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.692 ' HE2' ' HA ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.87 -94.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -176.682 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.59 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -60.88 1.94 0.13 Allowed 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 113.682 0.993 . . . . 0.0 113.682 -174.876 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.86 -117.01 9.63 Favored Glycine 0 N--CA 1.445 -0.759 0 N-CA-C 108.359 -1.896 . . . . 0.0 108.359 -174.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.565 ' HG2' HG22 ' A' ' 50' ' ' ILE . 0.3 OUTLIER -75.49 -68.51 0.56 Allowed 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 107.24 -1.392 . . . . 0.0 107.24 168.572 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.872 ' HG2' HD12 ' A' ' 59' ' ' LEU . 3.6 tpt85 -160.34 9.37 0.1 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.303 -1.317 . . . . 0.0 108.223 174.643 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.966 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.3 OUTLIER -58.73 -72.89 0.09 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 114.407 -1.27 . . . . 0.0 113.893 -173.244 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.647 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -36.01 -49.0 1.57 Allowed Pre-proline 0 CA--C 1.539 0.546 0 N-CA-C 113.318 0.858 . . . . 0.0 113.318 -175.454 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.538 ' O ' ' HB3' ' A' ' 33' ' ' GLN . 51.4 Cg_exo -59.39 -42.12 51.86 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.39 2.06 . . . . 0.0 113.573 -178.72 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.847 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.52 -46.84 62.87 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 120.458 -0.497 . . . . 0.0 109.987 -178.627 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.614 HD11 HD23 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -74.57 -12.95 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.589 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.056 177.913 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.667 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 1.1 tt0 -62.46 -39.19 92.58 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 176.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.85 -30.5 69.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.432 -0.804 . . . . 0.0 108.881 174.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.53 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 7.4 mtt -100.3 26.0 7.02 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.254 177.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.667 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.7 p-80 -64.98 -32.22 6.37 Favored Pre-proline 0 CA--C 1.536 0.418 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -177.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.614 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 42.8 Cg_exo -33.65 -35.47 0.08 OUTLIER 'Trans proline' 0 C--N 1.365 1.405 0 C-N-CA 122.288 1.992 . . . . 0.0 112.133 179.212 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.486 ' HB ' ' H ' ' A' ' 39' ' ' LEU . 2.7 m -78.1 -88.87 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.458 175.877 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.531 ' HB3' ' CD1' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -171.79 66.6 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.723 -0.217 . . . . 0.0 111.399 177.668 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.521 ' HB1' ' HB ' ' A' ' 32' ' ' ILE . . . -48.13 -32.67 7.21 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.565 179.561 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.647 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -46.41 -60.26 4.8 Favored Glycine 0 CA--C 1.518 0.256 0 CA-C-N 115.988 -0.551 . . . . 0.0 114.384 -178.283 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.858 ' HE3' ' HG3' ' B' ' 12' ' ' GLU . 4.4 tptm -77.27 -33.23 55.91 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.938 0.369 . . . . 0.0 111.943 -177.364 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.602 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 29.9 mt -54.01 -57.67 5.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.739 -0.21 . . . . 0.0 111.062 -179.212 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.966 ' HA ' HD22 ' A' ' 28' ' ' LEU . 9.3 t -50.16 -42.61 51.31 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.889 0.376 . . . . 0.0 110.244 178.58 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.89 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -49.35 -67.13 1.88 Allowed Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.681 -0.691 . . . . 0.0 113.296 -179.822 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.724 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.4 -47.26 76.16 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.74 0.27 . . . . 0.0 111.488 -178.157 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.445 ' O ' ' HB ' ' A' ' 50' ' ' ILE . 3.0 mm? -79.87 6.07 12.1 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -178.538 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.594 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.94 -10.58 40.3 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.915 0.388 . . . . 0.0 110.507 179.836 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.447 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 1.6 mm-40 -82.37 21.36 0.95 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.232 177.458 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.613 HD11 ' HE3' ' A' ' 68' ' ' LYS . 0.4 OUTLIER -83.53 160.73 3.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.991 -179.377 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.481 ' HB2' ' HG3' ' A' ' 54' ' ' GLU . 0.9 OUTLIER -70.87 156.61 39.36 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.658 -178.835 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.922 ' HA ' HD23 ' A' ' 55' ' ' LEU . 4.6 m120 -85.85 -27.87 24.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.197 178.037 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.82 -34.32 64.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.153 0.501 . . . . 0.0 109.769 177.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.539 ' O ' ' HG2' ' A' ' 58' ' ' MET . 4.5 mt-10 -76.43 -29.22 56.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.79 179.187 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.922 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -58.98 -45.92 89.39 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.959 0.409 . . . . 0.0 109.961 179.495 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.548 ' HA ' HD11 ' A' ' 59' ' ' LEU . 0.4 OUTLIER -60.25 -44.35 95.34 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.668 179.453 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -64.96 -13.68 58.05 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.057 179.626 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.687 ' SD ' ' HE2' ' A' ' 68' ' ' LYS . 31.7 mmt -76.29 -56.91 4.21 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.466 -179.691 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.872 HD12 ' HG2' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -67.1 -8.57 31.69 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 121.105 0.479 . . . . 0.0 110.429 178.927 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.541 ' N ' HD22 ' A' ' 59' ' ' LEU . 1.1 tp10 -98.61 -16.42 19.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.502 179.188 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.511 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 1.2 t -122.71 87.97 49.94 Favored Pre-proline 0 C--N 1.332 -0.153 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.373 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -60.22 -31.57 93.24 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.345 2.03 . . . . 0.0 111.89 179.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.462 ' O ' ' HB2' ' A' ' 67' ' ' SER . 6.9 mm-40 -77.87 -50.34 12.45 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.475 -179.693 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 67.8 m -69.38 -53.31 20.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.444 -178.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.847 HD21 HD13 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -57.99 -62.56 1.72 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.645 -178.177 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.679 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -49.93 -35.68 24.83 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.022 -177.639 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.506 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.2 OUTLIER -69.59 -36.14 75.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.159 0.504 . . . . 0.0 110.048 178.046 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.813 ' HG2' HD21 ' B' ' 6' ' ' LEU . 0.1 OUTLIER -66.4 -53.88 30.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.659 179.248 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.559 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 40.0 t -68.05 -19.08 24.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.317 178.537 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.694 ' O ' HG22 ' A' ' 73' ' ' VAL . 19.4 t0 -55.68 -48.75 74.54 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 176.596 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.522 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 1.2 tp10 -69.05 -26.34 64.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.739 176.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.602 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -60.78 -47.94 84.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.924 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.694 HG22 ' O ' ' A' ' 70' ' ' ASP . 4.9 m -60.2 -28.33 41.41 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.156 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 177.108 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.522 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -71.43 -30.26 65.85 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.133 178.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.599 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -69.12 -36.16 71.99 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 CA-C-O 120.812 0.339 . . . . 0.0 110.476 179.592 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.646 HD12 ' HB3' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -71.73 -56.32 6.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.939 179.782 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.444 ' HG3' ' O ' ' A' ' 74' ' ' ALA . 0.0 OUTLIER -52.41 -36.66 54.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.134 0.492 . . . . 0.0 110.332 179.794 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.8 -24.38 38.58 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.756 178.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.584 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 77.2 t60 -65.15 -55.61 17.65 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.727 179.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -78.86 2.47 19.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.008 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.85 -71.62 0.24 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.207 -179.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.12 -13.81 59.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.258 -179.428 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.584 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 0.3 OUTLIER -76.09 -40.05 53.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.953 -179.892 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.77 -36.44 83.87 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.972 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -84.07 -6.69 59.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.862 179.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.61 -58.43 2.58 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.886 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -77.41 -61.46 1.98 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.98 -179.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -88.43 86.75 7.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.197 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.1 t -85.94 63.94 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.909 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 58.2 m-20 -80.37 138.35 36.67 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.95 -179.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.99 -66.83 0.89 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.911 179.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -83.25 142.41 31.15 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.033 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -103.69 168.33 9.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.912 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -99.74 85.49 0.65 Allowed Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.388 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.424 ' HA ' ' HD3' ' A' ' 96' ' ' PRO . 4.3 p -92.43 124.61 58.81 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 120.728 0.299 . . . . 0.0 111.039 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 95' ' ' VAL . 68.8 Cg_endo -89.77 -66.21 0.01 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.707 0 C-N-CA 122.856 2.371 . . . . 0.0 112.757 -179.247 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.91 174.24 9.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.94 -179.676 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 12.0 p . . . . . 0 C--O 1.249 1.054 0 CA-C-O 117.914 -1.041 . . . . 0.0 111.089 179.926 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.803 0.335 . . . . 0.0 111.007 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.4 p -94.46 153.58 3.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.019 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.54 77.39 2.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.918 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . 0.415 ' HB2' ' O ' ' B' ' 7' ' ' ASN . 0.0 OUTLIER -82.43 172.06 13.47 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.841 -179.877 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 49.1 m-80 -107.02 -67.27 0.96 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.32 -179.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.813 HD21 ' HG2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -62.57 -73.34 0.11 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.006 -179.394 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . 0.601 HD22 ' H ' ' B' ' 9' ' ' ASN . 1.4 t30 -90.5 128.78 47.48 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.186 -179.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -77.79 -1.07 11.25 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.259 1.972 . . . . 0.0 111.798 178.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' ASN . . . . . 0.601 ' H ' HD22 ' B' ' 7' ' ' ASN . 26.6 m120 -123.41 52.12 1.43 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.682 179.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . 0.724 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.41 98.25 0.06 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.892 -179.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.582 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 2.7 mmtm -121.97 141.32 51.44 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.54 178.344 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . 0.858 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 17.2 mp0 -50.24 162.4 0.22 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.948 0.404 . . . . 0.0 111.999 -179.058 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 13' ' ' PHE . . . . . 0.89 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.9 OUTLIER -88.09 82.87 7.07 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.614 177.809 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.787 HG23 ' HD3' ' B' ' 15' ' ' PRO . 1.2 m -127.89 -34.81 0.04 OUTLIER Pre-proline 0 CA--C 1.539 0.52 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 -175.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 15' ' ' PRO . . . . . 0.787 ' HD3' HG23 ' B' ' 14' ' ' VAL . 99.7 Cg_exo -45.01 -33.42 7.69 Favored 'Trans proline' 0 C--N 1.357 1.004 0 C-N-CA 121.832 1.688 . . . . 0.0 112.777 -179.073 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.33 -33.43 2.02 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.468 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.479 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 1.6 m -94.85 -175.19 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.688 0.28 . . . . 0.0 110.648 179.548 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.9 96.25 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.808 -179.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.457 ' CG ' ' HG2' ' B' ' 15' ' ' PRO . 0.6 OUTLIER -80.9 100.48 8.9 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.983 -179.494 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 74.32 76.69 0.7 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.351 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . 0.514 ' ND2' HG12 ' B' ' 22' ' ' ILE . 0.4 OUTLIER -100.16 -37.95 8.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.95 0.405 . . . . 0.0 111.105 -179.566 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . 0.514 HG12 ' ND2' ' B' ' 21' ' ' ASN . 19.2 pt . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.184 -0.912 . . . . 0.0 111.203 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.24 0 N-CA-C 112.489 -0.244 . . . . 0.0 112.489 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_exo -56.98 -58.74 0.81 Allowed 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.535 2.156 . . . . 0.0 112.246 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -77.99 119.13 21.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.973 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -97.1 -23.37 14.99 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.571 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.435 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 0.3 OUTLIER -89.08 140.78 29.03 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-O 120.58 0.228 . . . . 0.0 110.893 179.909 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 5' ' ' SER . 35.3 Cg_exo -60.0 146.2 96.54 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.513 2.142 . . . . 0.0 112.223 -179.77 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.468 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.0 OUTLIER -86.65 127.23 34.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.814 179.792 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.767 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 8.9 t -87.9 -29.36 20.92 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.503 -179.623 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.406 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.32 -39.4 82.97 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 176.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 10.9 t -69.69 -33.63 72.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.763 177.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.767 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.4 mtm -64.29 -37.04 86.08 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 116.169 -0.469 . . . . 0.0 109.888 177.726 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.761 HD11 ' HB3' ' A' ' 24' ' ' LEU . 1.4 mp -52.0 -51.83 54.66 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.205 179.125 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.22 -31.92 73.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.441 178.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.57 23.61 10.93 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.343 -0.39 . . . . 0.0 112.002 -178.137 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.601 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -138.15 118.4 10.07 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 120.555 0.217 . . . . 0.0 111.285 179.582 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.43 168.96 1.25 Allowed 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.511 2.141 . . . . 0.0 111.961 179.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.81 -33.73 98.65 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.31 2.007 . . . . 0.0 112.299 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -73.41 -9.53 58.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.031 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.69 ' HG3' ' HB3' ' A' ' 22' ' ' GLN . 5.8 tp10 -89.68 11.35 20.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.074 -179.536 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.447 ' NE2' ' HG2' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -52.05 -58.36 6.76 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.387 -179.908 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.576 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.93 -21.81 22.67 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.543 -178.242 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.69 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 20.8 tp60 -73.39 -80.27 0.07 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.992 0.425 . . . . 0.0 111.654 179.683 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.626 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.62 -94.94 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -176.7 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.761 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -59.96 -1.34 0.28 Allowed 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 -174.819 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.577 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 65.06 -116.93 9.47 Favored Glycine 0 N--CA 1.446 -0.648 0 N-CA-C 108.501 -1.84 . . . . 0.0 108.501 -174.54 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.465 ' HB3' ' HB2' ' A' ' 55' ' ' LEU . 0.7 OUTLIER -76.2 -67.23 0.7 Allowed 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 169.592 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.849 ' HG3' HD21 ' A' ' 31' ' ' LEU . 6.5 tpt180 -159.65 7.06 0.1 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.247 -1.342 . . . . 0.0 108.06 175.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.92 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.3 OUTLIER -59.19 -78.06 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.441 -1.254 . . . . 0.0 114.26 -172.906 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.615 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -32.88 -48.84 0.58 Allowed Pre-proline 0 CA--C 1.541 0.601 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -175.099 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.592 ' CD ' ' HB2' ' A' ' 24' ' ' LEU . 20.1 Cg_endo -63.44 -39.33 37.31 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.336 2.024 . . . . 0.0 113.817 -178.107 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 1.001 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.44 -45.48 65.72 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 119.997 -0.681 . . . . 0.0 109.506 179.981 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.511 HD11 HD23 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -73.46 -13.29 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.688 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.698 177.46 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.652 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -62.52 -38.1 88.63 Favored 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 177.213 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.41 -28.98 65.49 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 174.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.57 ' HE2' HH11 ' A' ' 66' ' ' ARG . 7.8 mtt -100.16 25.61 7.32 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.087 177.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.652 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -64.62 -31.49 5.75 Favored Pre-proline 0 CA--C 1.536 0.422 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 -177.471 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.611 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 35.7 Cg_exo -33.31 -34.98 0.07 OUTLIER 'Trans proline' 0 C--N 1.364 1.352 0 C-N-CA 122.339 2.026 . . . . 0.0 112.034 178.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.492 ' HB ' ' H ' ' A' ' 39' ' ' LEU . 0.2 OUTLIER -78.01 -90.99 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 175.383 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.492 ' H ' ' HB ' ' A' ' 38' ' ' THR . 0.1 OUTLIER -171.88 67.07 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.649 -0.251 . . . . 0.0 111.307 177.163 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.536 ' HA ' HD12 ' A' ' 43' ' ' ILE . . . -46.38 -28.74 1.43 Allowed 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.922 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.615 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -50.45 -62.08 5.43 Favored Glycine 0 CA--C 1.518 0.27 0 CA-C-N 116.172 -0.467 . . . . 0.0 113.941 -178.375 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.558 ' HE3' ' HG3' ' B' ' 12' ' ' GLU . 4.6 tptm -74.95 -33.71 61.96 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.021 0.378 . . . . 0.0 112.021 -177.299 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.655 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 30.5 mt -54.36 -57.37 6.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.432 -178.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.92 ' HA ' HD22 ' A' ' 28' ' ' LEU . 9.0 t -51.2 -45.52 61.88 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.898 0.38 . . . . 0.0 110.519 178.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.624 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -49.66 -64.8 3.2 Favored Glycine 0 N--CA 1.451 -0.311 0 CA-C-N 115.689 -0.687 . . . . 0.0 113.282 -179.452 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.541 ' HB2' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.64 -47.57 76.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.83 0.315 . . . . 0.0 111.79 -178.374 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.418 HD22 ' HG3' ' A' ' 46' ' ' MET . 3.5 mm? -80.18 6.58 11.35 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.649 0.24 . . . . 0.0 111.649 -178.733 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.624 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.17 -7.01 15.4 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.989 0.423 . . . . 0.0 110.77 179.897 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.434 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 3.2 mt-10 -81.67 16.85 1.61 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.295 177.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -83.1 160.78 3.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.112 -179.187 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.464 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 1.5 m-20 -71.11 158.17 36.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.805 -178.765 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.821 ' HA ' HD23 ' A' ' 55' ' ' LEU . 3.9 m120 -86.69 -28.97 22.8 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.841 177.431 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.75 -32.62 63.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.37 0.605 . . . . 0.0 109.519 177.08 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.464 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -75.7 -28.59 58.66 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.564 179.168 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.821 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -60.52 -47.22 87.12 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.002 0.429 . . . . 0.0 110.348 179.533 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.451 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 52.1 tp -58.1 -43.69 87.23 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.555 179.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.475 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 1.7 t-80 -59.37 -41.29 88.98 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.67 179.122 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.543 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -61.21 -38.68 87.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.353 178.933 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.555 HD12 ' CZ ' ' A' ' 27' ' ' ARG . 7.3 tt -68.11 -20.36 64.92 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.349 178.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.475 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 2.2 pt-20 -107.02 -2.62 20.92 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.458 -179.274 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.581 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 15.9 m -122.52 88.37 49.42 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.251 -178.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -62.19 -31.96 82.72 Favored 'Trans proline' 0 C--N 1.343 0.258 0 C-N-CA 122.1 1.867 . . . . 0.0 111.688 178.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.564 ' O ' ' HB2' ' A' ' 67' ' ' SER . 5.0 mt-10 -78.45 -50.44 11.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.765 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.9 t -69.17 -52.38 28.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.082 0.468 . . . . 0.0 111.424 -178.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 1.001 HD21 HD13 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -58.13 -64.3 0.96 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.62 -177.882 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.624 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -51.13 -35.04 33.6 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.195 -177.553 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.564 ' HB2' ' O ' ' A' ' 63' ' ' GLU . 0.2 OUTLIER -69.7 -36.41 75.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.9 0.381 . . . . 0.0 110.315 178.428 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -66.32 -56.45 11.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.318 179.005 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.558 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 45.3 t -64.56 -21.07 28.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.492 179.039 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.662 ' O ' HG22 ' A' ' 73' ' ' VAL . 26.7 t70 -56.35 -48.4 76.87 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 176.713 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.473 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 0.8 OUTLIER -68.9 -26.76 65.26 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.751 176.449 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.655 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -60.58 -46.62 89.54 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.527 -0.761 . . . . 0.0 111.07 179.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.662 HG22 ' O ' ' A' ' 70' ' ' ASP . 3.6 m -61.24 -29.5 45.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 177.392 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.473 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -70.32 -28.41 65.14 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.151 179.248 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.581 HG22 ' O ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -69.87 -36.58 70.06 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.171 0 CA-C-O 120.811 0.338 . . . . 0.0 110.571 179.544 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.481 ' CD1' ' HB3' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -71.49 -53.99 12.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.134 -179.917 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.469 ' HG3' ' O ' ' A' ' 74' ' ' ALA . 0.0 OUTLIER -52.58 -37.97 59.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.272 0.558 . . . . 0.0 110.283 -179.965 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.11 -21.9 42.73 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.762 178.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.525 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 31.7 t60 -70.69 -54.98 9.79 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.133 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -67.68 -5.1 14.26 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.416 -179.301 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -71.59 -65.85 0.7 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.262 -179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.2 -4.17 52.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.369 -179.631 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.525 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 0.1 OUTLIER -84.78 -48.31 9.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.11 -179.74 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -72.57 -2.79 21.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.191 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.18 -45.13 89.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.979 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.435 ' H ' ' HG2' ' A' ' 86' ' ' GLN . 7.4 pt20 -89.07 103.45 16.06 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.861 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 11.7 mtmm -94.08 25.9 3.52 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.887 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -87.52 67.07 9.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.165 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.411 HG13 ' O ' ' A' ' 89' ' ' VAL . 3.0 p -101.68 84.78 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.206 0.527 . . . . 0.0 110.899 179.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -104.65 12.41 32.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.934 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.13 0.43 56.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.035 -179.713 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.28 -167.91 0.86 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.075 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 1.4 p -113.67 -166.75 1.12 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.01 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -77.19 -100.44 0.17 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.833 -0.698 . . . . 0.0 112.623 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 3.2 t -83.75 110.14 23.14 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-O 120.593 0.235 . . . . 0.0 111.181 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -75.84 73.74 4.68 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.901 2.401 . . . . 0.0 112.221 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -103.05 95.72 6.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.844 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.0 m . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.043 -0.979 . . . . 0.0 111.22 -179.651 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 29.0 m . . . . . 0 N--CA 1.487 1.403 0 CA-C-O 120.786 0.327 . . . . 0.0 110.893 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 11.9 p -96.08 151.43 4.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.224 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 24.8 mttm -77.39 -143.16 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.041 178.036 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . 0.664 ' HB2' ' HB2' ' B' ' 10' ' ' ALA . 6.0 t -79.7 -177.11 5.72 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.824 0.345 . . . . 0.0 111.208 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -103.87 -49.53 3.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.706 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 7.9 mt -66.7 -69.11 0.33 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.459 179.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . 0.551 HD22 ' H ' ' B' ' 9' ' ' ASN . 1.2 t30 -94.68 129.38 36.46 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.961 179.115 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.494 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 3.6 Cg_exo -76.49 -4.8 15.46 Favored 'Trans proline' 0 N--CA 1.462 -0.358 0 C-N-CA 122.563 2.175 . . . . 0.0 112.344 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' ASN . . . . . 0.551 ' H ' HD22 ' B' ' 7' ' ' ASN . 72.2 m-20 -123.61 48.7 1.82 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.986 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . 0.664 ' HB2' ' HB2' ' B' ' 4' ' ' SER . . . -55.44 97.19 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.616 -179.399 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.542 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -122.71 134.07 54.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.039 178.975 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . 0.558 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 11.5 tt0 -49.17 173.22 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -177.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 13' ' ' PHE . . . . . 0.505 ' CE1' ' HG ' ' A' ' 48' ' ' LEU . 0.2 OUTLIER -86.94 77.12 9.28 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.712 179.005 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.842 ' H ' ' HD2' ' B' ' 15' ' ' PRO . 0.9 OUTLIER -109.5 -37.87 0.13 Allowed Pre-proline 0 C--N 1.323 -0.571 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.331 -176.303 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 15' ' ' PRO . . . . . 0.842 ' HD2' ' H ' ' B' ' 14' ' ' VAL . 11.7 Cg_endo -54.82 -45.74 38.67 Favored 'Trans proline' 0 C--N 1.356 0.923 0 C-N-CA 121.948 1.766 . . . . 0.0 112.552 -178.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 83.69 -26.27 4.77 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.254 -179.563 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.732 HG22 ' H ' ' B' ' 18' ' ' LYS . 1.9 p -94.88 -175.51 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 110.433 -0.21 . . . . 0.0 110.433 179.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.732 ' H ' HG22 ' B' ' 17' ' ' VAL . 15.9 mttt -59.66 89.84 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.85 0.357 . . . . 0.0 110.857 -179.598 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.542 ' CE2' ' HG2' ' B' ' 11' ' ' LYS . 1.1 t80 -85.53 120.94 27.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.994 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 89.59 30.98 12.01 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.228 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 59.5 t30 -94.0 161.9 14.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.653 0.263 . . . . 0.0 110.922 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 2.8 tp . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.251 -0.881 . . . . 0.0 111.05 -179.972 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.217 0 N-CA-C 112.518 -0.233 . . . . 0.0 112.518 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.532 ' HA ' ' HG3' ' A' ' 6' ' ' PRO . 49.6 Cg_exo -55.79 108.38 0.32 Allowed 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.63 2.22 . . . . 0.0 112.294 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.7 tp -75.62 -69.25 0.5 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.905 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -91.46 -98.37 1.27 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.422 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.661 ' N ' ' HA ' ' A' ' 6' ' ' PRO . 1.7 t -82.58 -41.03 0.9 Allowed Pre-proline 0 CA--C 1.538 0.495 0 N-CA-C 111.892 0.33 . . . . 0.0 111.892 179.771 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.661 ' HA ' ' N ' ' A' ' 5' ' ' SER . 8.3 Cg_exo -71.41 149.06 91.46 Favored 'Cis proline' 0 C--N 1.359 1.099 0 CA-C-N 119.627 0.902 . . . . 0.0 112.565 -1.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.495 ' HB3' ' NE2' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -89.76 170.59 10.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.816 179.967 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.774 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 15.0 t -88.21 -30.29 19.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.399 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.24 -35.65 74.04 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 176.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 40.7 t -72.91 -34.29 66.52 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.894 177.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.774 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 10.6 mtm -64.15 -35.86 82.17 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.804 177.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.704 ' HA ' ' HE2' ' A' ' 23' ' ' MET . 5.6 mp -52.9 -55.63 21.83 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.995 178.273 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.9 -24.73 66.9 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.686 178.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.7 m -101.52 25.07 8.82 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.477 -179.222 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.74 ' HB1' ' HB2' ' A' ' 19' ' ' GLU . . . -134.07 61.66 52.46 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.889 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.508 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 51.0 Cg_exo -53.99 -49.94 15.37 Favored 'Trans proline' 0 CA--C 1.536 0.59 0 C-N-CA 122.781 2.321 . . . . 0.0 113.698 -178.438 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.508 ' HD3' ' HB2' ' A' ' 16' ' ' PRO . 16.7 Cg_exo -67.19 -167.62 0.15 Allowed 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 122.061 1.841 . . . . 0.0 112.076 -179.423 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -74.36 60.11 0.83 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.744 178.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.74 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 2.8 mm-40 -89.56 9.41 26.8 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.015 -179.16 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.454 ' O ' HD12 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -46.35 -64.51 0.74 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.894 0.378 . . . . 0.0 110.997 -179.039 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.638 ' HD2' ' HA ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER -56.49 -23.14 37.31 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.313 -179.512 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.502 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 2.7 tp60 -73.47 -75.98 0.14 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.771 0.32 . . . . 0.0 111.538 179.555 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.704 ' HE2' ' HA ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -68.99 -96.58 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 112.613 0.598 . . . . 0.0 112.613 -176.332 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.648 HD22 ' HD3' ' A' ' 27' ' ' ARG . 0.4 OUTLIER -62.13 3.08 0.19 Allowed 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -175.309 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.49 -117.28 10.29 Favored Glycine 0 N--CA 1.445 -0.761 0 N-CA-C 108.258 -1.937 . . . . 0.0 108.258 -174.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.526 ' O ' HD13 ' A' ' 24' ' ' LEU . 0.4 OUTLIER -75.49 -69.34 0.49 Allowed 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 168.609 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.787 ' NE ' HD12 ' A' ' 59' ' ' LEU . 9.9 tpt85 -160.44 10.08 0.1 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.188 -1.369 . . . . 0.0 107.768 174.164 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.951 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.09 -71.62 0.12 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 114.549 -1.205 . . . . 0.0 113.728 -173.14 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.639 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -36.28 -48.92 1.69 Allowed Pre-proline 0 CA--C 1.54 0.583 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -176.24 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.656 ' HB2' ' NH1' ' A' ' 27' ' ' ARG . 42.6 Cg_exo -61.4 -41.12 43.35 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 122.511 2.141 . . . . 0.0 113.874 -178.174 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.907 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -69.98 -45.94 66.25 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.359 0.6 . . . . 0.0 109.556 -179.094 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.826 HD11 HD23 ' A' ' 28' ' ' LEU . 0.7 OUTLIER -75.96 -12.09 14.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.021 177.381 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.639 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 3.5 tp-100 -62.44 -38.86 91.4 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.315 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.76 -31.22 70.11 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 174.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.499 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 5.7 mtt -100.23 27.35 5.72 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.261 178.121 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.639 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -64.92 -32.71 7.04 Favored Pre-proline 0 CA--C 1.536 0.405 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -177.171 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.554 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 61.5 Cg_exo -37.12 -30.39 0.11 Allowed 'Trans proline' 0 C--N 1.36 1.178 0 C-N-CA 122.187 1.925 . . . . 0.0 112.36 179.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.848 HG21 HG13 ' A' ' 73' ' ' VAL . 37.2 m -78.65 -84.62 0.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.183 177.42 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.452 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.4 OUTLIER -171.12 49.84 0.03 OUTLIER 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.39 179.219 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.471 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -38.23 -38.11 0.33 Allowed 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.378 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.639 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -51.29 -55.49 19.11 Favored Glycine 0 CA--C 1.518 0.226 0 C-N-CA 121.248 -0.501 . . . . 0.0 113.789 -179.185 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.828 ' HB3' HD11 ' A' ' 76' ' ' LEU . 3.5 tptm -77.18 -32.21 55.94 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -177.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.8 HD12 HG21 ' A' ' 32' ' ' ILE . 0.5 OUTLIER -54.96 -56.55 10.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.121 -179.255 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.951 ' HA ' HD22 ' A' ' 28' ' ' LEU . 11.8 t -51.37 -44.52 62.13 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.616 179.566 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.763 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -48.63 -68.86 1.13 Allowed Glycine 0 C--O 1.227 -0.297 0 CA-C-N 115.917 -0.583 . . . . 0.0 113.321 -179.376 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.605 ' SD ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.41 -46.76 76.61 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -178.192 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.412 HD22 ' N ' ' A' ' 47' ' ' LEU . 3.4 mm? -80.31 7.93 8.53 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -178.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.634 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.94 -13.97 60.71 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.86 0.362 . . . . 0.0 110.767 179.894 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.544 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.0 mt-10 -78.6 19.18 0.5 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.731 178.629 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.764 HD11 ' NZ ' ' A' ' 68' ' ' LYS . 1.2 tt -83.22 163.97 2.84 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.982 -179.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.476 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 1.8 m-20 -71.25 156.37 39.62 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.836 -179.108 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.831 ' HA ' HD23 ' A' ' 55' ' ' LEU . 3.2 m120 -87.12 -28.21 22.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.75 176.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.7 m -74.14 -30.99 62.55 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 176.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.476 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.6 OUTLIER -75.4 -31.17 60.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.31 178.926 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.831 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.5 OUTLIER -59.28 -45.98 89.77 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.404 179.845 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.468 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 38.6 tp -58.8 -44.24 90.72 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.817 179.438 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.466 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 4.6 m80 -65.04 -38.73 91.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.126 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.563 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -60.62 -38.02 83.34 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.101 0.477 . . . . 0.0 110.14 178.828 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.787 HD12 ' NE ' ' A' ' 27' ' ' ARG . 7.6 tt -69.61 -20.25 63.63 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.411 178.837 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 57' ' ' HIS . 4.3 pt-20 -106.91 -1.45 22.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.517 -179.34 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.594 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 5.9 m -122.95 78.91 50.52 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.223 -179.556 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.452 ' O ' ' HB2' ' A' ' 66' ' ' ARG . 50.5 Cg_exo -55.69 -33.19 86.67 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.243 1.962 . . . . 0.0 111.993 179.408 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -78.21 -50.39 12.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.824 -179.363 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.594 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 50.2 m -70.43 -51.35 30.04 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.92 0.391 . . . . 0.0 111.535 -177.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.907 HD21 HD13 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -57.81 -59.33 5.39 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.282 -178.658 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.645 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -52.51 -30.46 30.41 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.796 -178.379 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.539 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.4 OUTLIER -69.44 -38.33 77.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.106 0.479 . . . . 0.0 110.134 178.005 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.764 ' NZ ' HD11 ' A' ' 50' ' ' ILE . 5.7 mtpp -65.65 -59.01 4.38 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.287 178.661 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.515 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 52.8 t -61.73 -21.53 26.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.606 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.539 ' HB3' ' O ' ' A' ' 67' ' ' SER . 16.2 t70 -54.79 -49.45 70.93 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -68.84 -30.51 69.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.766 176.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.675 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -57.7 -40.57 79.82 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.105 177.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.848 HG13 HG21 ' A' ' 38' ' ' THR . 33.4 t -62.21 -31.11 50.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.526 176.759 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.3 -37.14 66.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.53 179.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.516 HG22 ' O ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -58.71 -28.17 36.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.963 0.411 . . . . 0.0 110.159 179.782 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.828 HD11 ' HB3' ' A' ' 42' ' ' LYS . 3.1 mm? -71.35 -53.72 13.2 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.876 178.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 20.8 mm100 -51.16 -35.44 35.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.372 179.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.56 -26.92 34.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.877 178.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.573 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 6.3 t60 -64.59 -50.4 67.36 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.162 -179.514 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -77.08 1.0 19.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.185 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -75.48 -65.14 0.93 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.099 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 9.5 mmtt -80.06 -4.62 53.48 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.168 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.573 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 1.0 OUTLIER -88.88 -42.09 12.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.036 -179.844 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.32 -30.21 71.03 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.049 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.51 -41.98 83.54 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.101 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 19.8 mm100 -82.7 174.42 11.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.873 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -77.56 160.34 28.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.893 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -78.98 75.25 5.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.943 179.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -91.09 106.16 17.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.011 -179.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -92.98 174.61 7.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.787 179.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 4.3 m -88.76 113.73 24.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.924 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -86.65 65.24 8.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.025 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 12.7 p -110.66 -75.03 0.63 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.839 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -106.01 102.42 1.95 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.351 179.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 3.2 t -107.95 91.6 7.96 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 120.637 0.256 . . . . 0.0 111.219 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -75.93 -4.21 14.87 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.594 2.196 . . . . 0.0 112.252 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.74 -73.3 0.39 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.022 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.5 t . . . . . 0 C--O 1.249 1.072 0 CA-C-O 117.946 -1.026 . . . . 0.0 111.064 -179.943 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 2.4 p . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 121.08 0.466 . . . . 0.0 110.951 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . 0.591 HG21 ' HB3' ' B' ' 10' ' ' ALA . 1.0 OUTLIER -99.77 171.26 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.996 179.846 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.41 42.05 1.09 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.937 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . 0.448 ' HB3' ' HB2' ' B' ' 10' ' ' ALA . 0.2 OUTLIER -73.37 153.11 40.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.018 -179.909 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 27.5 m-20 -107.7 -60.64 1.68 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.816 179.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.18 -85.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.827 179.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . 0.46 ' ND2' ' HB2' ' A' ' 49' ' ' GLU . 1.5 t30 -74.46 124.29 89.72 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.816 179.571 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -76.59 -0.74 10.77 Favored 'Trans proline' 0 N--CA 1.463 -0.316 0 C-N-CA 122.138 1.892 . . . . 0.0 111.81 179.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 9' ' ' ASN . . . . . 0.417 ' H ' HD22 ' B' ' 7' ' ' ASN . 23.4 m120 -123.12 51.15 1.47 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.57 179.437 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . 0.591 ' HB3' HG21 ' B' ' 2' ' ' VAL . . . -60.06 97.91 0.05 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.627 -179.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.544 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 2.8 mttp -122.85 138.09 54.75 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.498 178.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . 0.628 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 4.9 mp0 -48.43 166.03 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.026 0.441 . . . . 0.0 112.13 -178.841 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 13' ' ' PHE . . . . . 0.763 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.8 OUTLIER -87.74 86.41 7.17 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.87 -0.604 . . . . 0.0 109.699 178.726 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.852 HG23 ' HD3' ' B' ' 15' ' ' PRO . 0.8 OUTLIER -129.56 -36.2 0.03 OUTLIER Pre-proline 0 CA--C 1.541 0.599 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -175.755 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 15' ' ' PRO . . . . . 0.852 ' HD3' HG23 ' B' ' 14' ' ' VAL . 90.4 Cg_exo -45.97 -33.3 10.85 Favored 'Trans proline' 0 C--N 1.357 1.002 0 C-N-CA 121.868 1.712 . . . . 0.0 112.746 -178.809 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . 0.512 ' O ' ' HD2' ' A' ' 21' ' ' LYS . . . 80.45 -34.42 2.25 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.462 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.638 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 11.8 m -94.77 -174.67 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.631 0.253 . . . . 0.0 110.743 179.562 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.71 95.13 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.93 0.395 . . . . 0.0 110.775 -179.662 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.509 ' CG ' ' HG2' ' B' ' 15' ' ' PRO . 0.7 OUTLIER -79.1 124.38 28.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.023 -179.28 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 86.5 63.06 1.5 Allowed Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.304 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -98.81 -19.54 17.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.781 0.324 . . . . 0.0 111.087 -179.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 9.5 mt . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.271 -0.871 . . . . 0.0 111.044 -179.951 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.17 0 N-CA-C 112.478 -0.249 . . . . 0.0 112.478 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -72.97 132.77 18.77 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.517 2.145 . . . . 0.0 112.35 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -94.15 84.8 4.52 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.914 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -107.05 10.43 40.25 Favored Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.357 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.638 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 5.8 t -86.46 -48.99 0.51 Allowed Pre-proline 0 CA--C 1.533 0.32 0 N-CA-C 111.595 0.22 . . . . 0.0 111.595 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.638 ' HD2' ' N ' ' A' ' 5' ' ' SER . 13.2 Cg_endo -56.3 -22.77 42.71 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 122.354 2.036 . . . . 0.0 112.453 -179.611 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.455 ' O ' ' HG3' ' A' ' 11' ' ' MET . 79.6 mt -86.19 93.23 8.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.773 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.732 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 3.0 t -87.97 -34.59 18.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.624 -179.383 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.49 -34.92 69.57 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 177.533 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.3 t -72.22 -36.76 69.23 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.947 177.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.732 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 3.4 mtm -64.59 -37.56 87.99 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.422 178.248 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.792 HD21 ' HB3' ' A' ' 24' ' ' LEU . 65.1 mt -52.76 -50.38 63.62 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.946 179.37 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.39 -26.02 67.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.816 177.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.4 m -101.67 15.19 29.7 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.667 -178.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.946 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -134.38 60.59 44.42 Favored Pre-proline 0 CA--C 1.533 0.323 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.745 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.463 ' N ' ' HD2' ' A' ' 17' ' ' PRO . 50.7 Cg_exo -55.02 -50.25 13.82 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 122.829 2.352 . . . . 0.0 114.124 -177.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.463 ' HD2' ' N ' ' A' ' 16' ' ' PRO . 42.4 Cg_endo -66.86 -163.19 0.07 OUTLIER 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 122.044 1.829 . . . . 0.0 112.591 -178.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -74.5 55.46 0.64 Allowed 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.745 179.07 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.946 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 15.7 tp10 -93.02 10.98 29.12 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.594 -179.489 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.592 ' HG2' ' N ' ' A' ' 21' ' ' LYS . 0.1 OUTLIER -50.87 -51.12 54.66 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.326 -179.151 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.676 ' HD2' ' HA ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER -56.37 -26.55 53.29 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.514 -178.327 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.799 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 2.5 tp-100 -73.42 -76.65 0.12 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.92 0.391 . . . . 0.0 111.702 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.651 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -68.99 -97.73 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -176.492 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.792 ' HB3' HD21 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -59.05 -1.37 0.17 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -176.014 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.526 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 65.06 -118.17 11.69 Favored Glycine 0 N--CA 1.442 -0.901 0 N-CA-C 108.524 -1.83 . . . . 0.0 108.524 -174.764 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.475 ' HG2' HG22 ' A' ' 50' ' ' ILE . 0.4 OUTLIER -76.34 -67.07 0.73 Allowed 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 169.737 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.852 ' HG3' HD21 ' A' ' 31' ' ' LEU . 9.5 tpt180 -160.03 10.11 0.11 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 114.507 -1.224 . . . . 0.0 108.403 177.031 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.502 HD12 HD11 ' A' ' 32' ' ' ILE . 4.2 mm? -57.89 -82.41 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.72 -1.127 . . . . 0.0 113.795 -173.005 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.705 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -33.68 -50.0 0.79 Allowed Pre-proline 0 CA--C 1.537 0.471 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -175.071 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.606 ' CD ' ' HB2' ' A' ' 24' ' ' LEU . 12.2 Cg_endo -58.77 -40.6 71.19 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.415 2.076 . . . . 0.0 113.722 -177.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.852 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.52 -47.73 59.01 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 120.077 -0.649 . . . . 0.0 109.79 -179.666 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.522 ' O ' ' HB2' ' A' ' 40' ' ' ALA . 0.3 OUTLIER -73.31 -14.1 16.51 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.156 178.647 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.627 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 55.0 tp60 -62.15 -38.64 89.78 Favored 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 177.016 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.9 -31.1 70.64 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.063 174.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.541 ' HE1' ' HA ' ' A' ' 66' ' ' ARG . 7.0 mtt -101.24 27.54 6.1 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.317 178.062 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.627 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 2.4 p-80 -64.37 -31.91 6.54 Favored Pre-proline 0 CA--C 1.537 0.458 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 -177.306 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.605 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 49.2 Cg_exo -34.71 -34.96 0.1 OUTLIER 'Trans proline' 0 C--N 1.362 1.257 0 C-N-CA 122.29 1.994 . . . . 0.0 112.411 179.399 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.482 HG22 HD12 ' A' ' 76' ' ' LEU . 31.9 m -78.3 -86.52 0.06 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.189 -0.459 . . . . 0.0 109.869 176.765 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.714 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -171.36 62.32 0.03 OUTLIER 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.364 178.406 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.522 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -48.44 -33.29 9.04 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.784 0.326 . . . . 0.0 111.578 179.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.648 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -45.26 -59.41 4.62 Favored Glycine 0 CA--C 1.518 0.24 0 CA-C-N 115.841 -0.618 . . . . 0.0 114.169 -178.262 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.866 ' HZ1' ' HA ' ' B' ' 12' ' ' GLU . 0.1 OUTLIER -78.26 -36.13 47.21 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.332 0.494 . . . . 0.0 112.332 -177.622 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.642 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 20.9 mt -53.06 -53.71 20.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.4 -177.657 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.586 HG21 ' CD2' ' A' ' 29' ' ' PHE . 5.1 t -47.9 -43.04 28.48 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-O 121.153 0.502 . . . . 0.0 109.786 177.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.889 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -51.78 -66.38 2.6 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.167 -0.924 . . . . 0.0 113.656 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.641 ' SD ' ' HE3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.33 -47.45 75.64 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -177.225 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.444 HD22 ' N ' ' A' ' 47' ' ' LEU . 3.3 mm? -79.98 3.46 20.0 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 121.145 -0.222 . . . . 0.0 111.564 -178.852 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.526 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.13 -11.6 50.17 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.842 0.354 . . . . 0.0 110.913 179.991 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.421 ' OE1' ' HG3' ' B' ' 11' ' ' LYS . 1.3 mm-40 -77.85 16.36 0.72 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.967 0.413 . . . . 0.0 110.554 178.309 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.488 HD11 ' NZ ' ' A' ' 68' ' ' LYS . 0.3 OUTLIER -83.77 158.77 3.64 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.048 -179.496 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.4 ' O ' HG23 ' A' ' 50' ' ' ILE . 2.2 m-20 -71.25 161.7 30.66 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.817 -179.111 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.926 ' HA ' HD23 ' A' ' 55' ' ' LEU . 1.8 m120 -83.92 -28.6 27.75 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.125 177.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.3 t -73.85 -36.67 64.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.081 -0.508 . . . . 0.0 109.961 178.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.426 ' HG2' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -75.71 -23.77 56.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.656 179.548 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.926 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -62.61 -47.15 85.02 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 120.916 0.389 . . . . 0.0 109.967 178.939 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.408 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 38.5 tp -58.12 -43.68 87.33 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.526 179.099 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.519 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 0.4 OUTLIER -57.76 -42.09 83.31 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.804 179.257 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.632 ' SD ' ' HE2' ' A' ' 68' ' ' LYS . 19.9 mmt -60.23 -44.08 95.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.072 0.463 . . . . 0.0 110.329 178.528 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.494 HD22 ' NE ' ' A' ' 27' ' ' ARG . 8.4 tp -68.46 -16.29 63.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.777 179.513 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.519 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 0.1 OUTLIER -106.81 0.32 23.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.95 179.51 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.629 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 5.5 m -125.66 82.7 63.29 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.121 -179.591 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -58.32 -35.28 98.87 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.217 1.945 . . . . 0.0 111.935 179.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.463 ' O ' ' HB2' ' A' ' 67' ' ' SER . 31.6 mt-10 -78.3 -47.79 17.06 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.887 -179.21 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.629 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 36.9 m -71.7 -53.12 14.52 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.815 0.34 . . . . 0.0 111.709 -177.779 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.81 HD21 HD13 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -57.94 -62.11 2.05 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.302 -178.476 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.675 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.6 OUTLIER -50.14 -34.05 20.94 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.861 -178.086 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.479 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.5 OUTLIER -69.6 -38.05 77.15 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.105 0.478 . . . . 0.0 110.228 177.806 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.725 ' HG2' HD22 ' B' ' 6' ' ' LEU . 0.2 OUTLIER -65.96 -58.2 6.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.316 178.938 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.542 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 28.0 t -62.99 -18.99 22.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.509 179.037 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.68 ' O ' HG22 ' A' ' 73' ' ' VAL . 25.1 t0 -56.14 -49.1 74.88 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 176.374 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.491 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 0.5 OUTLIER -69.08 -24.71 64.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.765 176.481 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.642 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -63.91 -43.85 94.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.811 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.68 HG22 ' O ' ' A' ' 70' ' ' ASP . 2.5 m -61.35 -29.93 46.95 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 177.15 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -68.41 -38.33 81.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.103 178.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.618 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.15 -35.44 52.9 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-O 120.995 0.426 . . . . 0.0 110.042 179.221 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.714 ' HG ' ' HB3' ' A' ' 39' ' ' LEU . 2.6 tm? -69.26 -47.06 65.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.065 178.487 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -54.25 -37.26 64.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.652 179.54 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.24 -23.95 37.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.784 178.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 16.0 t-160 -59.23 -69.75 0.19 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.992 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -64.56 -6.51 7.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.228 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.74 -65.14 1.04 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.443 -179.56 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 45.4 mttm -77.32 -22.6 51.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.585 -178.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -74.57 -48.22 28.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.695 0.284 . . . . 0.0 110.86 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -71.63 -25.72 62.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.018 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.08 -28.58 68.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.017 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -85.49 -16.36 39.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.878 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -85.24 69.84 10.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.946 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -79.03 91.03 4.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.146 -179.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -103.9 -37.55 4.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.996 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -96.43 -26.72 15.22 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.86 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -86.19 117.59 25.11 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.915 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -92.32 84.96 5.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.005 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.79 -67.81 0.95 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.931 -179.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -97.57 49.38 1.46 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.42 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 11.5 p -86.72 133.01 40.63 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-O 120.549 0.214 . . . . 0.0 111.007 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -78.45 59.02 6.97 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.618 2.212 . . . . 0.0 112.504 -179.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 43.7 m -107.8 -49.69 3.18 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.906 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.025 -0.988 . . . . 0.0 111.042 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 13.0 p . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.817 0.341 . . . . 0.0 111.046 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 8.2 t -95.61 119.49 43.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.99 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 6.4 mtpm? -77.78 130.67 37.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.944 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 8.9 t -79.74 174.72 11.3 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.964 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 24.1 m-20 -104.21 -52.75 2.86 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.876 179.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.725 HD22 ' HG2' ' A' ' 68' ' ' LYS . 11.9 mt -66.07 -89.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.765 179.72 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . 0.565 HD22 ' H ' ' B' ' 9' ' ' ASN . 0.6 OUTLIER -77.47 119.75 78.7 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.955 179.299 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 9.8 Cg_exo -72.34 0.26 7.66 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.344 2.029 . . . . 0.0 111.953 179.416 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 9' ' ' ASN . . . . . 0.565 ' H ' HD22 ' B' ' 7' ' ' ASN . 17.4 m-80 -123.01 45.55 2.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.605 179.494 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . 0.639 ' HB1' ' HB2' ' A' ' 46' ' ' MET . . . -59.49 98.45 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.505 -179.377 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.4 OUTLIER -117.25 138.16 51.91 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.666 179.185 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . 0.866 ' HA ' ' HZ1' ' A' ' 42' ' ' LYS . 0.4 OUTLIER -50.89 160.82 0.42 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.159 -0.473 . . . . 0.0 112.127 -178.758 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 13' ' ' PHE . . . . . 0.889 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.7 OUTLIER -88.14 89.61 8.06 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.472 177.951 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.623 ' H ' ' HD2' ' B' ' 15' ' ' PRO . 21.8 t -124.69 -53.06 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.271 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -176.683 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 15' ' ' PRO . . . . . 0.623 ' HD2' ' H ' ' B' ' 14' ' ' VAL . 98.9 Cg_exo -44.45 -34.3 7.41 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 122.315 2.01 . . . . 0.0 112.811 -178.274 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . 0.467 ' O ' ' HD2' ' A' ' 21' ' ' LYS . . . 75.63 -18.23 3.07 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.341 -179.789 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.676 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 12.5 m -94.85 -174.04 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.548 0.214 . . . . 0.0 110.663 179.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.415 ' HG2' ' NE2' ' A' ' 20' ' ' GLN . 12.4 mttm -59.93 95.46 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.894 0.378 . . . . 0.0 110.93 -179.449 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.481 ' CE1' ' HG2' ' B' ' 15' ' ' PRO . 0.1 OUTLIER -81.76 106.86 14.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.842 -179.737 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 90.57 70.74 1.22 Allowed Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.875 -0.678 . . . . 0.0 112.34 -179.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -93.36 -19.34 21.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.842 0.353 . . . . 0.0 110.938 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 11.4 mt . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.082 179.955 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.21 0 CA-C-O 120.144 -0.253 . . . . 0.0 112.496 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_exo -72.67 126.65 11.89 Favored 'Cis proline' 0 C--N 1.348 0.55 0 C-N-CA 123.618 -1.409 . . . . 0.0 112.284 0.377 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.82 119.04 22.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.859 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -100.45 -17.84 23.0 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.774 -0.726 . . . . 0.0 112.391 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.4 m -92.73 111.01 49.13 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 120.564 0.221 . . . . 0.0 110.926 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -68.48 107.89 1.71 Allowed 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.476 2.117 . . . . 0.0 112.248 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.457 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.3 OUTLIER -93.9 116.83 29.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.074 -179.847 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.742 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 5.2 t -87.78 -34.72 18.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.35 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.4 -37.68 78.62 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 176.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.3 t -66.96 -35.36 79.8 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.805 177.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.742 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.5 mtm -64.46 -38.52 91.3 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.19 178.155 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.93 HD21 ' HB3' ' A' ' 24' ' ' LEU . 49.0 mt -52.29 -44.56 65.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.342 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.27 -34.3 77.68 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.96 178.288 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.4 m -101.75 18.49 20.31 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.676 -179.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.513 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -140.17 114.76 7.66 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.089 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.458 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 40.0 Cg_exo -56.82 169.45 1.83 Allowed 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.542 2.161 . . . . 0.0 112.09 179.738 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -57.33 -30.16 86.73 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.404 2.07 . . . . 0.0 112.134 179.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -72.1 -12.53 61.25 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.953 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.513 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.4 OUTLIER -88.5 6.8 36.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.879 179.996 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.665 ' HG2' ' N ' ' A' ' 21' ' ' LYS . 1.6 pm0 -48.64 -51.9 25.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.905 -176.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.686 ' HD2' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -59.97 -23.29 63.48 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.567 -0.453 . . . . 0.0 111.692 -177.586 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.686 ' N ' ' HD2' ' A' ' 21' ' ' LYS . 5.2 tt0 -73.5 -78.97 0.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.041 0.448 . . . . 0.0 111.682 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.698 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.66 -96.22 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -175.898 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.93 ' HB3' HD21 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -60.77 -2.17 0.51 Allowed 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -174.931 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.68 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.65 -116.52 9.11 Favored Glycine 0 N--CA 1.447 -0.576 0 N-CA-C 108.449 -1.861 . . . . 0.0 108.449 -174.488 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.761 ' HG2' HG22 ' A' ' 50' ' ' ILE . 0.3 OUTLIER -76.28 -68.56 0.57 Allowed 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 168.646 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.871 ' HE ' HD13 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -159.92 9.03 0.1 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.176 -1.374 . . . . 0.0 108.022 174.445 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.982 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.03 -74.39 0.07 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.139 -1.391 . . . . 0.0 113.896 -172.982 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.658 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -35.38 -49.14 1.26 Allowed Pre-proline 0 CA--C 1.538 0.504 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -175.646 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.576 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 52.0 Cg_exo -58.83 -43.35 44.55 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 122.316 2.011 . . . . 0.0 113.648 -178.722 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.779 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.54 -47.2 61.52 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 120.269 -0.572 . . . . 0.0 110.002 -178.509 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.836 HG21 HD12 ' A' ' 43' ' ' ILE . 0.6 OUTLIER -73.43 -12.93 15.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.909 178.073 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.602 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.7 OUTLIER -62.19 -38.54 89.51 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 177.147 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.56 -31.4 70.58 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.039 174.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.518 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 6.6 mtt -100.84 27.99 5.55 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.228 178.061 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.602 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 3.7 p-80 -64.9 -31.69 5.77 Favored Pre-proline 0 CA--C 1.536 0.407 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 -177.232 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.554 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 63.0 Cg_exo -37.75 -29.97 0.13 Allowed 'Trans proline' 0 C--N 1.362 1.286 0 C-N-CA 122.137 1.891 . . . . 0.0 112.278 179.236 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.809 HG21 HG13 ' A' ' 73' ' ' VAL . 6.4 m -78.14 -86.11 0.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.04 177.137 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.495 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.3 OUTLIER -171.39 50.52 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.488 -0.323 . . . . 0.0 111.246 178.642 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.44 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -37.78 -36.84 0.2 Allowed 'General case' 0 N--CA 1.467 0.413 0 O-C-N 123.312 0.382 . . . . 0.0 111.92 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.658 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.34 -60.1 5.97 Favored Glycine 0 C--N 1.329 0.173 0 CA-C-N 116.042 -0.526 . . . . 0.0 113.821 -179.409 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.556 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -77.32 -30.47 54.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.983 0.392 . . . . 0.0 111.989 -177.681 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.836 HD12 HG21 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -54.0 -54.95 16.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 C-N-CA 121.077 -0.249 . . . . 0.0 111.155 -179.281 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.982 ' HA ' HD22 ' A' ' 28' ' ' LEU . 10.7 t -51.56 -47.57 63.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.628 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.577 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -49.8 -59.76 7.08 Favored Glycine 0 CA--C 1.518 0.264 0 C-N-CA 121.161 -0.543 . . . . 0.0 113.309 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.549 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -56.32 -53.79 53.08 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.788 0.294 . . . . 0.0 111.475 -178.731 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.581 ' HB2' HD21 ' A' ' 28' ' ' LEU . 2.9 mm? -80.02 10.19 4.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.819 -178.414 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.577 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -65.99 -17.62 64.8 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.872 0.368 . . . . 0.0 110.731 179.602 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.486 ' HB2' ' ND2' ' B' ' 7' ' ' ASN . 2.0 mm-40 -74.79 17.74 0.2 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.862 179.465 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.761 HG22 ' HG2' ' A' ' 26' ' ' GLU . 0.1 OUTLIER -83.98 160.08 3.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.88 -179.977 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.493 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 1.5 m-20 -70.71 156.82 39.01 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -178.334 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.958 ' HA ' HD23 ' A' ' 55' ' ' LEU . 2.2 m120 -84.21 -29.62 26.41 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.237 178.153 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.9 m -74.22 -35.18 63.88 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.422 0.629 . . . . 0.0 109.594 177.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.493 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -76.58 -21.6 55.39 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.688 179.657 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.958 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.9 OUTLIER -65.66 -47.54 75.16 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-O 121.001 0.429 . . . . 0.0 110.04 178.782 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.431 ' N ' HD12 ' A' ' 55' ' ' LEU . 2.7 tt -56.18 -44.31 79.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.685 179.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -56.61 -39.65 73.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.568 -179.503 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.527 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -57.36 -52.82 63.81 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -178.815 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.871 HD13 ' HE ' ' A' ' 27' ' ' ARG . 0.5 OUTLIER -61.53 -19.69 62.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.736 0.303 . . . . 0.0 111.171 -179.364 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -102.57 -6.22 23.05 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.603 178.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.555 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 52.4 m -122.72 81.76 48.65 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.729 -179.757 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.43 ' O ' ' HB2' ' A' ' 66' ' ' ARG . 19.6 Cg_endo -58.01 -30.57 90.45 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.338 2.026 . . . . 0.0 112.189 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -78.4 -50.5 11.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.954 -179.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.436 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 73.1 m -74.6 -29.67 61.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.967 -177.539 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.779 HD21 HD13 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -78.68 -60.03 2.54 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.006 -178.329 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.704 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -53.6 -31.72 48.13 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.636 -0.425 . . . . 0.0 110.539 -178.674 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.487 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 3.0 m -67.82 -36.53 80.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.096 177.687 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.495 ' HE2' ' HE2' ' A' ' 58' ' ' MET . 0.3 OUTLIER -65.31 -60.1 3.35 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.973 178.399 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.48 ' CG1' HG23 ' A' ' 32' ' ' ILE . 69.5 t -64.16 -19.71 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.731 -179.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.487 ' HB3' ' O ' ' A' ' 67' ' ' SER . 10.9 t70 -55.25 -50.67 68.89 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 176.84 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.442 ' O ' HG13 ' A' ' 75' ' ' VAL . 0.4 OUTLIER -69.22 -30.69 68.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.773 176.777 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.705 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -57.29 -42.41 81.64 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.307 178.299 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.809 HG13 HG21 ' A' ' 38' ' ' THR . 20.9 t -61.8 -31.12 50.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 176.888 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.417 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -73.51 -37.0 65.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.54 179.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.565 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.64 -27.81 35.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-O 120.95 0.405 . . . . 0.0 110.207 179.803 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.582 HD21 HG12 ' A' ' 43' ' ' ILE . 3.0 mm? -71.68 -54.85 9.01 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.639 178.526 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 64.3 mm-40 -51.18 -33.23 26.31 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.372 179.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.28 -32.76 33.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.745 178.24 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.461 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 71.2 t60 -61.21 -48.46 81.41 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.873 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -83.38 0.71 44.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.066 179.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.55 -69.64 0.57 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.394 -179.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.12 -4.14 30.81 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.243 -179.313 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.461 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 13.7 tt0 -91.29 -52.92 4.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.044 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -78.2 -8.38 58.25 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.242 -179.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -74.35 -58.63 3.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.145 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -86.36 -71.28 0.55 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.026 -179.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.08 92.28 4.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.896 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -80.93 -0.15 37.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.187 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -94.96 35.74 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.003 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -78.5 -22.74 46.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.935 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.9 -82.12 0.2 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.098 -179.727 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -81.46 166.23 20.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.085 -179.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -93.68 162.64 13.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.871 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -86.41 56.14 4.73 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.483 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.565 ' N ' ' CD ' ' A' ' 96' ' ' PRO . 9.9 p -84.14 -30.49 0.46 Allowed Pre-proline 0 CA--C 1.54 0.58 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.565 ' CD ' ' N ' ' A' ' 95' ' ' VAL . 96.4 Cg_endo -78.95 126.22 7.03 Favored 'Trans proline' 0 C--N 1.357 1.022 0 C-N-CA 121.783 1.655 . . . . 0.0 112.356 179.663 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 9.2 p -105.84 -76.14 0.61 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.971 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 9.1 m . . . . . 0 C--O 1.25 1.117 0 CA-C-O 118.175 -0.916 . . . . 0.0 111.081 -179.955 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 2.2 t . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.819 0.342 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 36.5 t -81.64 132.86 30.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.949 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 13.3 mtmm -86.46 113.55 22.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.942 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 15.5 t -77.84 -177.58 4.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.862 179.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 5' ' ' ASN . . . . . 0.413 ' HB2' ' HG2' ' A' ' 71' ' ' GLU . 25.7 m120 -104.05 -47.96 4.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.847 179.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.3 mt -73.11 -78.5 0.09 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.678 179.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . 0.619 HD22 ' H ' ' B' ' 9' ' ' ASN . 0.8 OUTLIER -84.0 125.18 73.42 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.022 179.815 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -77.78 0.54 9.73 Favored 'Trans proline' 0 N--CA 1.461 -0.406 0 C-N-CA 122.195 1.93 . . . . 0.0 112.038 178.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 9' ' ' ASN . . . . . 0.619 ' H ' HD22 ' B' ' 7' ' ' ASN . 55.9 m-80 -123.44 49.63 1.68 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.796 179.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . 0.549 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.66 97.57 0.06 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.576 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.485 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 0.3 OUTLIER -117.41 167.71 11.02 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.478 178.559 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -67.25 167.93 11.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.691 0.281 . . . . 0.0 110.86 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 13' ' ' PHE . . . . . 0.432 ' CZ ' HD21 ' A' ' 48' ' ' LEU . 1.0 OUTLIER -88.64 117.35 27.54 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.855 -179.61 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 12.0 t -115.43 83.63 10.93 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.551 178.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 15' ' ' PRO . . . . . 0.684 ' HB3' ' HA ' ' A' ' 22' ' ' GLN . 51.7 Cg_exo -55.47 -179.35 0.07 OUTLIER 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.834 2.356 . . . . 0.0 113.057 -178.711 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.08 -45.22 3.48 Favored Glycine 0 N--CA 1.451 -0.33 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.563 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 1.4 t -116.54 140.81 37.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.723 0.297 . . . . 0.0 111.217 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.645 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 3.4 mttt -60.67 108.91 0.91 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.842 179.813 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -79.89 106.43 11.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.95 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 74.56 81.01 0.48 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.462 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -92.67 -33.5 14.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.054 0.454 . . . . 0.0 110.998 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 3.5 tp . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.199 -0.905 . . . . 0.0 111.115 179.942 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.266 0 N-CA-C 112.429 -0.268 . . . . 0.0 112.429 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -77.42 166.81 25.45 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.548 2.165 . . . . 0.0 112.407 -179.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 8.0 tp -98.1 2.35 48.56 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.881 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.4 ' O ' ' HD3' ' A' ' 6' ' ' PRO . . . -103.61 17.31 50.4 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.623 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 87.4 p -82.27 111.22 26.07 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 120.562 0.22 . . . . 0.0 110.94 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.537 ' HB3' ' HB3' ' A' ' 9' ' ' ALA . 25.5 Cg_exo -63.2 138.22 65.53 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.589 2.192 . . . . 0.0 112.297 -179.783 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.436 ' O ' ' HG3' ' A' ' 11' ' ' MET . 3.7 mm? -100.94 -71.3 0.71 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.876 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.805 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 5.0 t -88.01 -27.15 22.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.216 -179.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.537 ' HB3' ' HB3' ' A' ' 6' ' ' PRO . . . -59.39 -40.8 87.75 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 176.607 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.427 ' HB2' ' HB2' ' A' ' 6' ' ' PRO . 37.4 t -67.8 -34.6 77.09 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.555 177.071 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.805 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.7 mtm -64.37 -39.3 93.6 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.264 177.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.813 HD21 ' HB3' ' A' ' 24' ' ' LEU . 45.5 mt -52.3 -45.67 65.63 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.274 -179.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.15 -34.04 77.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.994 178.305 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 37.3 m -101.87 21.65 14.27 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.594 -178.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.574 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -138.0 116.1 9.58 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.159 179.848 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -55.25 168.38 1.4 Allowed 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.679 2.253 . . . . 0.0 112.258 179.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.88 -35.73 94.43 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.448 2.099 . . . . 0.0 112.454 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -70.0 -12.14 61.39 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.052 -179.769 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.574 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.4 OUTLIER -83.88 9.46 12.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.756 179.709 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.8 HE22 ' HB3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -48.19 -62.88 1.26 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.347 -179.735 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.755 ' HG3' HE21 ' A' ' 20' ' ' GLN . 0.0 OUTLIER -55.7 -23.37 28.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.703 -178.103 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.507 ' H ' ' HD3' ' A' ' 21' ' ' LYS . 15.8 tt0 -73.08 -79.15 0.08 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.894 0.378 . . . . 0.0 111.766 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.647 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.46 -95.9 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -176.602 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.813 ' HB3' HD21 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -59.77 -1.56 0.28 Allowed 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -175.428 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.587 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 65.08 -116.05 8.45 Favored Glycine 0 N--CA 1.445 -0.733 0 N-CA-C 108.548 -1.821 . . . . 0.0 108.548 -174.374 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.85 -68.51 0.57 Allowed 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 168.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.847 ' HB2' HD13 ' A' ' 55' ' ' LEU . 10.7 tpt180 -159.89 7.69 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 114.136 -1.393 . . . . 0.0 107.794 175.332 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.793 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -60.71 -71.98 0.12 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.236 -1.347 . . . . 0.0 113.93 -173.414 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.64 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -35.5 -48.12 1.24 Allowed Pre-proline 0 CA--C 1.541 0.603 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -175.926 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.61 ' CD ' ' HB2' ' A' ' 24' ' ' LEU . 20.9 Cg_endo -64.18 -39.11 32.39 Favored 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 122.201 1.934 . . . . 0.0 113.573 -178.027 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 1.02 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.14 -45.92 65.83 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.764 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.74 HG21 HD12 ' A' ' 43' ' ' ILE . 0.6 OUTLIER -74.24 -13.72 15.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.932 177.6 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.562 ' HB3' ' O ' ' A' ' 30' ' ' PRO . 1.4 tt0 -62.27 -38.19 88.37 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 177.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.04 -31.0 68.41 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 175.153 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.517 ' HE1' ' HA ' ' A' ' 66' ' ' ARG . 4.8 mtt -100.34 27.15 5.91 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.026 177.886 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.808 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 8.5 p-80 -66.32 -30.84 3.83 Favored Pre-proline 0 CA--C 1.536 0.439 0 N-CA-C 113.719 1.007 . . . . 0.0 113.719 -176.438 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.808 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 4.1 Cg_exo -39.19 -28.93 0.18 Allowed 'Trans proline' 0 C--N 1.361 1.203 0 C-N-CA 122.271 1.981 . . . . 0.0 112.098 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.845 HG21 HG13 ' A' ' 73' ' ' VAL . 32.9 m -78.43 -83.85 0.08 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.393 177.637 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.48 ' O ' HG13 ' A' ' 43' ' ' ILE . 0.2 OUTLIER -171.09 48.21 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.369 179.277 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.435 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -37.41 -37.85 0.21 Allowed 'General case' 0 N--CA 1.469 0.477 0 O-C-N 123.307 0.379 . . . . 0.0 111.975 -179.406 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.64 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.2 -59.76 6.13 Favored Glycine 0 C--N 1.33 0.235 0 CA-C-N 116.139 -0.482 . . . . 0.0 113.815 -179.259 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.889 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -77.49 -30.99 53.35 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.106 0.409 . . . . 0.0 112.106 -177.587 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.74 HD12 HG21 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -54.09 -56.24 10.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.113 -179.249 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.793 ' HA ' HD22 ' A' ' 28' ' ' LEU . 9.1 t -47.89 -49.34 30.04 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.083 -179.381 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.572 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -49.56 -61.94 5.19 Favored Glycine 0 CA--C 1.521 0.423 0 C-N-CA 121.153 -0.546 . . . . 0.0 113.595 -179.375 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.599 ' SD ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.2 -62.87 1.38 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.815 0.307 . . . . 0.0 111.827 -177.79 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.701 ' HB2' HD21 ' A' ' 28' ' ' LEU . 1.6 mm? -70.17 1.74 4.43 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 -177.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.591 ' HA ' HD13 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -66.52 -8.76 28.78 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.942 -0.303 . . . . 0.0 111.161 179.924 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.491 ' HG3' ' O ' ' B' ' 9' ' ' ASN . 2.7 mm-40 -74.65 16.14 0.3 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.414 0.626 . . . . 0.0 109.531 176.755 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.751 HD11 ' NZ ' ' A' ' 68' ' ' LYS . 0.2 OUTLIER -82.41 162.94 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.558 -179.833 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.505 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 3.5 m-20 -70.7 160.8 31.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.9 0.381 . . . . 0.0 111.873 -178.728 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.865 ' HA ' HD23 ' A' ' 55' ' ' LEU . 4.4 m120 -89.12 -29.35 19.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.689 177.272 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -73.9 -30.72 62.76 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 176.768 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.505 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.1 OUTLIER -78.22 -28.87 48.04 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.675 178.981 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.865 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.9 OUTLIER -58.69 -44.84 90.41 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 179.428 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.639 ' HA ' HD11 ' A' ' 59' ' ' LEU . 8.0 tt -57.74 -49.18 77.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.37 177.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -57.06 -22.64 40.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.685 -179.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.689 ' HB3' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -71.27 -53.67 13.52 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -178.754 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.865 HD13 ' H ' ' A' ' 59' ' ' LEU . 0.0 OUTLIER -68.11 -7.39 29.25 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 119.997 -0.681 . . . . 0.0 110.691 179.891 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.472 ' HG3' ' O ' ' A' ' 56' ' ' LEU . 4.9 mt-10 -99.46 -11.38 21.15 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.926 176.237 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.546 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 3.4 m -122.32 85.56 47.43 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.184 -179.026 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -62.51 -33.4 78.77 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.186 1.924 . . . . 0.0 111.65 178.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -78.44 -47.02 18.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.485 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.499 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 1.9 m -71.37 -54.9 9.19 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.917 0.389 . . . . 0.0 111.58 -178.304 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 1.02 HD21 HD13 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -58.21 -62.16 2.03 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.707 -177.805 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.688 ' N ' HD13 ' A' ' 65' ' ' LEU . 1.5 ttm180 -50.47 -37.16 36.94 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.746 -0.381 . . . . 0.0 111.345 -177.374 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.61 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 1.4 t -69.47 -34.53 74.5 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.312 0.577 . . . . 0.0 110.172 178.144 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.751 ' NZ ' HD11 ' A' ' 50' ' ' ILE . 3.0 ttpp -65.91 -57.23 8.33 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.161 178.716 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.528 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 37.1 t -64.93 -18.89 24.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.25 178.457 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.61 ' HB3' ' O ' ' A' ' 67' ' ' SER . 25.6 t70 -54.29 -48.72 70.96 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 176.727 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.435 ' HB3' HD13 ' B' ' 6' ' ' LEU . 18.5 tt0 -66.08 -35.17 79.79 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.682 176.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.643 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -55.33 -40.74 71.57 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.35 178.044 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.845 HG13 HG21 ' A' ' 38' ' ' THR . 9.9 t -60.7 -34.21 57.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.026 177.516 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.38 -35.09 65.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.696 -179.543 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.518 HG22 ' O ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -57.35 -29.68 33.68 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-O 121.019 0.438 . . . . 0.0 109.899 179.53 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.889 HD11 ' HB3' ' A' ' 42' ' ' LYS . 3.7 mm? -71.93 -54.95 8.43 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.772 178.11 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -50.91 -33.81 25.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.252 179.65 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.414 ' HA ' ' HB2' ' A' ' 82' ' ' LYS . . . -81.54 -32.59 32.18 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.662 177.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -61.58 -31.85 71.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.077 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.44 -63.95 1.25 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.78 -179.652 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.63 -57.88 3.46 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -176.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.414 ' HB2' ' HA ' ' A' ' 78' ' ' ALA . 11.1 mmtt -59.03 -20.22 51.08 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 -176.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -94.98 -38.16 10.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.687 0.28 . . . . 0.0 111.132 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -72.8 -20.27 61.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.114 -179.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -74.57 -70.63 0.39 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.975 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -90.49 89.64 7.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.719 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.41 ' H ' ' HG3' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -88.65 -80.12 0.29 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.797 179.836 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -86.68 -3.58 59.06 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.834 179.482 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.8 t -89.21 -13.12 9.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.934 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -79.44 72.97 6.1 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.914 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.5 p -98.56 33.42 2.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.805 179.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -74.73 178.85 5.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.997 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 3.3 p -112.26 154.37 25.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.971 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -85.93 156.7 30.19 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.76 -0.734 . . . . 0.0 112.443 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -108.0 97.73 22.7 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 120.751 0.31 . . . . 0.0 111.205 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.1 -23.68 24.53 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.524 2.149 . . . . 0.0 112.358 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -82.85 129.32 34.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.973 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.2 m . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.964 179.788 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 2.5 m . . . . . 0 N--CA 1.485 1.302 0 CA-C-O 120.839 0.352 . . . . 0.0 111.123 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 3.4 t -99.46 73.29 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.911 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 4.6 mmmt -87.14 22.83 1.96 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.937 -179.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . 0.551 ' HB3' ' HB2' ' B' ' 10' ' ' ALA . 0.3 OUTLIER -93.02 164.55 13.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.883 179.959 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -120.45 -59.52 1.76 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.977 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.487 HD21 ' HG2' ' A' ' 68' ' ' LYS . 7.2 tp -69.58 -72.76 0.18 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.09 -179.769 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . 0.538 HD22 ' H ' ' B' ' 9' ' ' ASN . 1.8 t30 -88.95 130.24 45.39 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.985 179.668 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 3.4 Cg_exo -76.66 -0.76 10.82 Favored 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 122.476 2.117 . . . . 0.0 112.007 179.347 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 9' ' ' ASN . . . . . 0.538 ' H ' HD22 ' B' ' 7' ' ' ASN . 68.9 m-20 -123.23 48.06 1.89 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.005 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . 0.579 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.37 99.15 0.07 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.812 -179.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.473 ' O ' ' HA ' ' A' ' 46' ' ' MET . 0.0 OUTLIER -122.37 153.58 38.83 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.679 178.407 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . 0.576 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 5.7 tt0 -55.4 169.85 0.27 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.916 0.388 . . . . 0.0 111.511 -179.464 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 13' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -88.34 112.99 23.49 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.581 179.554 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -113.41 86.96 10.67 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.541 179.226 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 15' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_endo -55.57 -172.22 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.746 2.298 . . . . 0.0 112.778 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.96 -51.1 4.51 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.271 -179.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -115.57 147.99 18.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.744 0.307 . . . . 0.0 110.967 179.5 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.8 ' HB3' HE22 ' A' ' 20' ' ' GLN . 0.0 OUTLIER -68.56 88.37 0.34 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.716 179.637 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.413 ' HE2' ' HB2' ' B' ' 11' ' ' LYS . 0.3 OUTLIER -67.07 115.3 6.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.984 -179.606 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 93.65 35.0 6.32 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.549 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -99.61 15.22 27.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.886 0.374 . . . . 0.0 110.924 179.764 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.959 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.193 0 N-CA-C 112.533 -0.227 . . . . 0.0 112.533 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -61.41 107.21 0.47 Allowed 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.581 2.187 . . . . 0.0 112.247 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.08 98.02 7.08 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.934 -179.886 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -91.54 53.93 3.08 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.52 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.41 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 0.1 OUTLIER -85.29 152.99 58.95 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 120.368 0.128 . . . . 0.0 110.797 179.922 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.595 ' HD2' ' HB2' ' A' ' 10' ' ' SER . 12.8 Cg_exo -70.49 -172.09 7.67 Favored 'Cis proline' 0 C--N 1.35 0.638 0 C-N-CA 123.916 -1.285 . . . . 0.0 112.586 -0.038 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.472 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.2 OUTLIER -88.93 -74.28 0.47 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.311 -179.546 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.737 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 8.9 t -87.8 -33.08 18.75 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.89 -178.703 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.5 ' HB3' ' HB2' ' A' ' 6' ' ' PRO . . . -59.09 -37.11 76.36 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 177.381 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.595 ' HB2' ' HD2' ' A' ' 6' ' ' PRO . 13.4 t -70.45 -34.01 71.96 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.884 177.559 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.737 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 11.8 mtm -64.29 -36.41 84.02 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 177.63 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.598 HD11 ' HB3' ' A' ' 24' ' ' LEU . 2.0 mp -52.12 -52.47 51.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.996 178.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.33 -28.7 68.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.233 178.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.2 p -101.4 17.73 21.92 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.953 -178.097 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.576 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -138.56 120.78 10.55 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.696 -0.229 . . . . 0.0 111.0 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.483 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 23.1 Cg_endo -60.13 169.69 4.66 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.415 2.077 . . . . 0.0 111.882 179.239 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -56.9 -32.13 91.38 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.362 2.042 . . . . 0.0 112.27 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.5 mt-30 -73.53 -9.84 59.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.107 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.576 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.5 OUTLIER -89.24 7.22 36.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.11 -179.536 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.573 HE21 ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -46.52 -60.5 2.32 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.745 -177.812 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.618 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -56.05 -22.38 27.19 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.913 -177.617 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.618 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 5.9 tt0 -73.37 -78.76 0.09 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.013 0.435 . . . . 0.0 111.428 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.628 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.3 -97.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.68 -176.396 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.628 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -59.62 -2.19 0.33 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -175.714 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.443 ' HA3' HD11 ' A' ' 48' ' ' LEU . . . 65.21 -115.55 7.85 Favored Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 108.672 -1.771 . . . . 0.0 108.672 -174.426 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.499 ' O ' HD13 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -75.8 -69.65 0.48 Allowed 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 169.386 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.919 ' HG2' HD22 ' A' ' 59' ' ' LEU . 4.8 tpt180 -159.48 13.01 0.14 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.377 -1.283 . . . . 0.0 108.156 175.48 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.543 HD12 HD11 ' A' ' 32' ' ' ILE . 4.2 mm? -57.41 -83.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.56 -1.2 . . . . 0.0 113.809 -173.187 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.673 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -33.04 -51.47 0.66 Allowed Pre-proline 0 CA--C 1.536 0.404 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 -174.846 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.593 ' HG2' ' O ' ' A' ' 27' ' ' ARG . 10.5 Cg_endo -56.39 -42.0 70.42 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.394 2.062 . . . . 0.0 113.646 -177.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.86 ' HB3' HD11 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.84 -48.26 54.91 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 120.128 -0.629 . . . . 0.0 109.893 -179.665 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.543 HD11 HD12 ' A' ' 28' ' ' LEU . 0.5 OUTLIER -71.33 -14.1 17.51 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.626 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.037 178.424 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.651 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 1.3 tp-100 -62.19 -39.29 92.23 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.196 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.77 -29.87 69.94 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.257 -0.883 . . . . 0.0 108.964 174.479 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.534 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 7.7 mtt -101.99 26.14 7.91 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.349 178.184 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.651 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -64.33 -31.98 6.69 Favored Pre-proline 0 CA--C 1.535 0.392 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -177.897 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.592 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 51.0 Cg_exo -35.0 -34.36 0.1 OUTLIER 'Trans proline' 0 C--N 1.364 1.365 0 C-N-CA 122.16 1.907 . . . . 0.0 112.008 178.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.43 ' HB ' ' H ' ' A' ' 39' ' ' LEU . 20.5 m -78.19 -89.63 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 175.723 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.596 HD23 HD11 ' A' ' 76' ' ' LEU . 3.1 tp -171.93 67.63 0.04 OUTLIER 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.427 177.448 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.516 ' HB1' ' HB ' ' A' ' 32' ' ' ILE . . . -50.24 -24.5 2.92 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.804 0.335 . . . . 0.0 111.573 179.542 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.624 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -49.89 -62.98 4.53 Favored Glycine 0 CA--C 1.518 0.265 0 CA-C-N 115.965 -0.562 . . . . 0.0 114.298 -178.177 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.661 ' HB3' HD12 ' A' ' 76' ' ' LEU . 2.4 tptm -77.42 -32.79 54.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 117.169 0.484 . . . . 0.0 112.03 -177.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.653 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 18.7 mt -54.21 -55.95 12.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.729 -0.214 . . . . 0.0 111.427 -178.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.58 HG21 ' CD2' ' A' ' 29' ' ' PHE . 4.7 t -47.69 -46.86 29.82 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.887 0.375 . . . . 0.0 110.473 179.077 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.717 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -54.44 -61.95 6.7 Favored Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 115.73 -0.668 . . . . 0.0 113.551 -179.559 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.528 ' SD ' ' HG3' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.73 -48.07 75.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.859 0.329 . . . . 0.0 111.414 -178.322 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.453 ' O ' ' HB ' ' A' ' 50' ' ' ILE . 3.2 mm? -80.1 2.43 24.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.439 -179.493 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.498 ' HG ' ' CD1' ' B' ' 13' ' ' PHE . 0.0 OUTLIER -65.93 -12.41 54.53 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.979 0.418 . . . . 0.0 110.392 179.333 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -78.95 17.85 0.69 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.277 177.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.453 ' HB ' ' O ' ' A' ' 47' ' ' LEU . 0.6 OUTLIER -83.58 162.74 3.07 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.876 -179.53 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.438 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 1.8 m-20 -70.76 158.84 35.6 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.769 -178.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.897 ' HA ' HD23 ' A' ' 55' ' ' LEU . 4.7 m120 -83.58 -28.28 28.65 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.788 177.178 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.645 ' HA ' HD21 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -74.51 -32.03 62.37 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.408 0.623 . . . . 0.0 109.902 177.419 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.438 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 1.0 OUTLIER -77.84 -26.61 49.53 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.483 178.92 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.897 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.5 OUTLIER -62.48 -49.66 74.53 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.654 179.984 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.692 ' HA ' HD21 ' A' ' 59' ' ' LEU . 0.4 OUTLIER -59.59 -40.98 89.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.985 -179.441 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 3.3 m-70 -63.06 -20.61 65.5 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.634 -179.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.533 ' HE2' ' HA ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -76.89 -60.0 2.54 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -178.77 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.919 HD22 ' HG2' ' A' ' 27' ' ' ARG . 2.5 pt? -66.69 -4.06 8.04 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.375 179.662 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.456 ' HB3' ' O ' ' A' ' 56' ' ' LEU . 1.3 tt0 -104.24 -19.12 14.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.894 177.663 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.446 ' HB3' ' HB2' ' A' ' 64' ' ' SER . 0.5 OUTLIER -122.52 87.14 49.08 Favored Pre-proline 0 C--O 1.223 -0.334 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.134 179.398 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -54.3 -34.11 78.74 Favored 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.469 2.113 . . . . 0.0 112.661 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.634 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.0 -48.7 15.59 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.617 -178.998 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.634 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 23.3 m -72.73 -26.68 61.67 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.176 0.512 . . . . 0.0 111.098 -179.193 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.86 HD11 ' HB3' ' A' ' 31' ' ' LEU . 0.2 OUTLIER -77.8 -65.79 0.92 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.155 -178.6 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.461 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.3 OUTLIER -49.75 -28.39 6.11 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.807 -177.854 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.462 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.5 OUTLIER -68.64 -39.56 80.68 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.25 178.348 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.491 ' HE2' ' HE2' ' A' ' 58' ' ' MET . 0.2 OUTLIER -65.03 -59.91 3.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.211 178.918 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.514 ' CG1' HG23 ' A' ' 32' ' ' ILE . 54.4 t -63.15 -20.51 26.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.007 -179.426 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.622 ' O ' HG22 ' A' ' 73' ' ' VAL . 23.8 t70 -55.07 -49.72 70.94 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 176.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.586 ' HG2' ' HB3' ' B' ' 5' ' ' ASN . 49.1 tt0 -68.97 -26.67 65.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.801 176.834 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.653 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -62.63 -51.84 65.69 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.367 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.622 HG22 ' O ' ' A' ' 70' ' ' ASP . 5.3 m -56.73 -28.43 27.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.161 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 177.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.538 ' O ' ' HG3' ' A' ' 77' ' ' GLN . . . -72.59 -30.62 64.53 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.342 179.33 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.801 HG12 ' HB2' ' B' ' 5' ' ' ASN . 1.0 OUTLIER -67.44 -37.41 78.86 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.189 0 CA-C-O 120.791 0.329 . . . . 0.0 110.532 179.617 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.661 HD12 ' HB3' ' A' ' 42' ' ' LYS . 0.3 OUTLIER -71.87 -52.7 16.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.945 179.548 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.538 ' HG3' ' O ' ' A' ' 74' ' ' ALA . 1.5 pp0? -56.05 -35.18 66.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.121 0.486 . . . . 0.0 109.997 179.556 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.91 -21.09 40.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.613 178.004 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.559 ' O ' ' HB3' ' A' ' 83' ' ' GLU . 11.3 t-160 -68.13 -30.01 69.05 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.718 179.452 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -77.73 6.07 8.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.121 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -80.24 -75.33 0.27 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.863 0.364 . . . . 0.0 111.631 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 5.2 mtmt -79.9 -23.4 41.84 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.792 -178.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.559 ' HB3' ' O ' ' A' ' 79' ' ' HIS . 1.0 OUTLIER -74.48 -34.65 63.15 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.77 0.319 . . . . 0.0 111.086 -179.185 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -75.07 3.62 8.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.418 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -70.63 -6.45 36.95 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.928 0.394 . . . . 0.0 111.008 179.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -92.34 -50.71 5.51 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.686 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.738 ' HB3' HG23 ' A' ' 89' ' ' VAL . 0.0 OUTLIER -79.85 156.33 27.41 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.894 179.998 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -89.52 22.47 2.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.065 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.738 HG23 ' HB3' ' A' ' 87' ' ' LYS . 1.4 t -91.81 17.23 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.901 179.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -94.58 123.73 38.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.973 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 87.4 p -87.52 162.6 17.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.846 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -88.6 95.57 10.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.059 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 33.9 p -95.7 85.92 4.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.91 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -94.58 -174.7 38.52 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.522 -179.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 26.5 t -87.53 113.86 56.14 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-O 120.557 0.218 . . . . 0.0 111.048 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -55.27 152.61 30.84 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.613 2.208 . . . . 0.0 112.335 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -84.17 -12.16 55.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.024 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 14.6 p . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.052 -0.975 . . . . 0.0 111.11 -179.754 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 6.2 m . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.773 0.32 . . . . 0.0 111.013 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -97.03 97.48 6.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.913 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 4.7 mtmm -85.34 81.53 8.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.903 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.01 -173.32 3.83 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.858 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 5' ' ' ASN . . . . . 0.801 ' HB2' HG12 ' A' ' 75' ' ' VAL . 2.0 m-20 -104.03 -78.13 0.56 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.929 -179.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' B' ' 6' ' ' LEU . 1.9 mt -67.52 -82.85 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.795 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . 0.404 HD22 ' H ' ' B' ' 9' ' ' ASN . 1.6 t30 -74.66 124.18 89.53 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.917 179.758 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.26 1.98 7.73 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.18 1.92 . . . . 0.0 111.791 178.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 9' ' ' ASN . . . . . 0.69 ' O ' ' HG2' ' B' ' 11' ' ' LYS . 22.8 m120 -123.23 48.54 1.81 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.7 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.33 98.5 0.06 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.708 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.69 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 19.9 mmtp -122.88 153.09 40.1 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.323 178.204 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -55.26 165.0 0.81 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.863 0.363 . . . . 0.0 111.12 -179.682 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 13' ' ' PHE . . . . . 0.717 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.2 t80 -88.38 68.6 8.91 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.741 -179.538 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.606 ' N ' ' CD ' ' B' ' 15' ' ' PRO . 5.9 m -131.57 26.27 0.12 Allowed Pre-proline 0 CA--C 1.539 0.536 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 15' ' ' PRO . . . . . 0.75 ' HG3' ' HB2' ' B' ' 19' ' ' TYR . 31.6 Cg_endo -57.74 -30.69 89.97 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 122.074 1.849 . . . . 0.0 112.689 179.271 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.41 -48.61 4.08 Favored Glycine 0 N--CA 1.449 -0.459 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 -176.001 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 22.7 m -115.75 -161.52 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 177.047 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.507 ' HB2' ' OD1' ' B' ' 21' ' ' ASN . 0.1 OUTLIER -61.47 113.53 2.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.693 0.282 . . . . 0.0 110.862 179.409 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.75 ' HB2' ' HG3' ' B' ' 15' ' ' PRO . 0.3 OUTLIER -85.3 104.93 15.59 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.013 -179.957 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 91.3 75.56 1.31 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.461 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . 0.507 ' OD1' ' HB2' ' B' ' 18' ' ' LYS . 19.2 m120 -94.02 -19.97 20.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.798 0.332 . . . . 0.0 110.984 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 3.2 pt . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.289 -0.862 . . . . 0.0 111.053 -179.862 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.232 0 N-CA-C 112.456 -0.258 . . . . 0.0 112.456 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_exo -57.06 137.9 83.93 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.654 2.236 . . . . 0.0 112.246 179.953 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.41 179.23 7.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.905 179.875 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.94 70.67 2.49 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.625 -179.965 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.614 ' H ' ' HD2' ' A' ' 6' ' ' PRO . 0.1 OUTLIER -93.05 -50.94 0.27 Allowed Pre-proline 0 CA--C 1.534 0.338 0 N-CA-C 111.486 0.18 . . . . 0.0 111.486 -179.973 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.614 ' HD2' ' H ' ' A' ' 5' ' ' SER . 33.4 Cg_endo -63.92 128.39 21.82 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 122.141 1.894 . . . . 0.0 112.25 179.992 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.459 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.1 OUTLIER -100.89 -63.78 1.1 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.239 -179.574 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.756 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 6.9 t -87.93 -33.3 18.52 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.647 -178.992 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.448 ' HB2' ' OE1' ' A' ' 33' ' ' GLN . . . -59.41 -35.63 74.34 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 177.341 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 5.5 t -71.23 -34.69 71.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.737 177.365 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.756 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.0 mtm -64.23 -36.25 83.48 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.85 177.692 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.713 HD11 ' HB3' ' A' ' 24' ' ' LEU . 1.9 mp -52.41 -53.53 43.91 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.895 178.768 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.42 -26.74 67.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.976 178.268 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.4 22.84 11.92 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.778 -178.654 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.76 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -134.23 59.97 40.98 Favored Pre-proline 0 CA--C 1.533 0.312 0 CA-C-O 120.611 0.243 . . . . 0.0 111.065 179.81 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.491 ' HD3' ' N ' ' A' ' 15' ' ' ALA . 51.7 Cg_exo -57.78 -51.24 8.45 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 122.797 2.331 . . . . 0.0 113.946 -178.165 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.416 ' HD2' ' N ' ' A' ' 16' ' ' PRO . 57.9 Cg_endo -70.18 -159.2 0.06 OUTLIER 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 121.901 1.734 . . . . 0.0 112.705 -178.683 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -73.62 68.6 1.21 Allowed 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.748 179.481 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.76 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.9 OUTLIER -104.42 15.73 27.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.608 179.883 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.414 ' NE2' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -53.11 -63.25 1.21 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.637 -179.565 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.466 ' H ' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -56.17 -21.35 22.35 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.2 -179.087 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.467 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 2.1 tp-100 -73.55 -81.04 0.07 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.973 0.416 . . . . 0.0 111.667 179.571 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.574 ' SD ' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.67 -97.11 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -176.272 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.713 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -56.93 0.71 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -175.183 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.604 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 65.12 -117.51 10.44 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 108.481 -1.848 . . . . 0.0 108.481 -174.783 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.432 ' HG3' ' HA ' ' A' ' 52' ' ' ASN . 0.3 OUTLIER -75.54 -68.03 0.61 Allowed 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 168.715 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.757 ' HB2' HD13 ' A' ' 55' ' ' LEU . 1.0 OUTLIER -160.51 7.69 0.09 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.121 -1.4 . . . . 0.0 107.914 174.784 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.98 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -59.73 -73.21 0.09 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.387 -1.279 . . . . 0.0 114.139 -173.064 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.649 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -36.46 -49.23 1.81 Allowed Pre-proline 0 CA--C 1.536 0.426 0 N-CA-C 113.612 0.968 . . . . 0.0 113.612 -175.789 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.6 ' HG3' ' HB2' ' A' ' 24' ' ' LEU . 18.9 Cg_endo -61.76 -39.33 53.56 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 122.19 1.926 . . . . 0.0 113.593 -177.41 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.727 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.15 -46.95 60.49 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 120.26 -0.576 . . . . 0.0 110.087 -179.496 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.596 HD11 HD23 ' A' ' 28' ' ' LEU . 0.7 OUTLIER -72.31 -17.71 18.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.294 -0.412 . . . . 0.0 109.925 177.71 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.636 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 1.0 OUTLIER -63.36 -31.98 73.28 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 176.286 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.25 -27.77 61.76 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 175.011 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.451 ' HE1' ' HB ' ' A' ' 69' ' ' VAL . 12.2 mtt -99.97 16.82 22.67 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 114.862 -1.063 . . . . 0.0 109.655 177.17 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.81 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 0.4 OUTLIER -63.45 -34.81 13.95 Favored Pre-proline 0 CA--C 1.534 0.345 0 CA-C-N 115.379 -0.828 . . . . 0.0 112.011 -179.235 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.81 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 2.2 Cg_endo -39.87 -30.05 0.35 Allowed 'Trans proline' 0 C--N 1.364 1.369 0 C-N-CA 122.106 1.871 . . . . 0.0 110.713 177.386 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.639 HG21 ' CG1' ' A' ' 73' ' ' VAL . 0.2 OUTLIER -78.18 -84.38 0.08 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.209 175.161 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.716 HD23 HD11 ' A' ' 76' ' ' LEU . 11.7 tp -172.15 63.41 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 177.603 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.34 -176.02 0.06 Allowed 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 175.736 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.649 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . 103.91 -69.21 0.28 Allowed Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.292 -0.956 . . . . 0.0 113.112 179.664 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.693 ' HE2' ' HG2' ' A' ' 46' ' ' MET . 1.0 OUTLIER -77.25 -34.97 55.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.825 0.345 . . . . 0.0 111.04 -179.655 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.698 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 17.6 mt -54.08 -53.03 31.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.108 -179.39 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.98 ' HA ' HD22 ' A' ' 28' ' ' LEU . 8.9 t -54.65 -43.75 72.63 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-O 120.9 0.381 . . . . 0.0 110.313 178.22 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.788 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -48.11 -61.27 5.02 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.573 -0.74 . . . . 0.0 113.457 -178.769 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.792 ' CE ' HG21 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -61.8 -50.08 73.78 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -177.757 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.751 HD13 ' HB2' ' B' ' 7' ' ' ASN . 4.0 mm? -78.75 11.05 2.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.602 0.239 . . . . 0.0 111.493 -179.018 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.632 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -63.79 -29.44 70.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.295 -179.186 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.32 29.02 0.15 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.772 0.32 . . . . 0.0 110.921 179.094 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.549 HD11 ' HZ2' ' A' ' 68' ' ' LYS . 2.5 tt -82.77 169.78 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.365 179.081 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.567 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 16.8 m-20 -67.54 137.59 55.86 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.537 -179.0 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.838 ' HA ' HD23 ' A' ' 55' ' ' LEU . 4.9 m120 -76.51 -27.71 56.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.171 0.51 . . . . 0.0 109.642 177.198 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 42.6 m -74.05 -31.27 62.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.639 177.437 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.567 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 2.2 mm-40 -77.51 -29.89 52.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.668 178.925 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.838 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -58.85 -46.73 87.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.284 -179.953 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.461 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 33.1 tp -61.64 -43.6 98.55 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.409 178.843 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 28.8 m80 -66.93 -19.41 65.72 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.982 179.79 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.514 ' SD ' ' HA ' ' A' ' 65' ' ' LEU . 17.9 mmt -72.4 -47.51 48.65 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.988 -179.983 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.595 HD23 ' CG ' ' A' ' 27' ' ' ARG . 0.2 OUTLIER -66.33 -20.91 66.22 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.229 -179.831 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -96.54 -7.54 34.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.716 0.293 . . . . 0.0 111.576 -179.316 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.627 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -122.88 88.39 50.51 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.891 -179.951 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -62.63 -32.1 79.24 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.302 2.001 . . . . 0.0 112.052 179.552 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.401 ' O ' ' HB2' ' A' ' 67' ' ' SER . 7.6 mt-10 -78.06 -48.84 15.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.498 -179.776 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 26.1 m -69.49 -48.8 59.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.394 -178.376 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.627 ' HB3' ' O ' ' A' ' 61' ' ' SER . 0.9 OUTLIER -59.75 -64.83 0.81 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.874 -178.662 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.615 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.5 OUTLIER -50.1 -29.38 8.88 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.068 -177.215 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.401 ' HB2' ' O ' ' A' ' 63' ' ' GLU . 0.6 OUTLIER -63.75 -43.96 94.91 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.078 0.466 . . . . 0.0 110.229 178.134 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.722 ' HG2' HD11 ' B' ' 6' ' ' LEU . 25.6 mtpt -66.16 -60.68 2.57 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.937 179.327 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.505 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 75.6 t -61.13 -23.18 29.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.194 -178.542 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.45 ' HB2' ' O ' ' A' ' 66' ' ' ARG . 24.8 t70 -55.58 -49.95 71.37 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 176.612 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.665 ' HG2' ' HB3' ' B' ' 5' ' ' ASN . 0.5 OUTLIER -68.9 -28.16 66.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.69 176.542 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.698 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -59.83 -37.66 79.84 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.068 177.933 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.639 ' CG1' HG21 ' A' ' 38' ' ' THR . 28.4 t -66.43 -29.63 47.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 176.975 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.413 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -71.11 -40.39 71.51 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.292 179.46 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.792 HG21 ' CE ' ' A' ' 46' ' ' MET . 0.9 OUTLIER -54.55 -39.33 45.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-O 120.96 0.41 . . . . 0.0 110.222 179.385 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.716 HD11 HD23 ' A' ' 39' ' ' LEU . 1.2 tt -64.28 -46.45 83.64 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.747 -178.751 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 8.7 mm100 -53.86 -35.85 61.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.263 179.428 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.25 -26.91 35.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.469 177.904 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.485 ' O ' ' HB3' ' A' ' 83' ' ' GLU . 4.2 t60 -77.39 -12.04 59.91 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.847 179.724 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -83.38 -35.76 24.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.549 179.427 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.63 -50.29 10.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.508 -179.275 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 3.8 mmtm -61.2 -38.84 88.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.556 -178.666 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.485 ' HB3' ' O ' ' A' ' 79' ' ' HIS . 17.3 tt0 -74.69 -50.94 15.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.322 -178.77 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.84 -26.11 68.47 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.531 -179.289 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.65 -74.04 0.11 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.203 -179.523 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -88.36 103.89 16.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.95 -179.705 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 24.2 mttt -93.82 39.38 1.07 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.7 179.919 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -85.92 -0.22 54.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.096 -179.749 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.13 -37.94 6.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.99 179.872 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -90.99 167.62 12.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.918 179.85 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -74.66 105.85 5.94 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.009 -179.91 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.12 -174.63 2.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.029 179.994 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 33.1 p -112.09 170.71 7.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.928 -179.997 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -88.31 -41.63 6.11 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.49 -179.923 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.431 HG12 ' HD2' ' A' ' 96' ' ' PRO . 0.2 OUTLIER -97.26 135.44 21.86 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.518 0.199 . . . . 0.0 110.954 179.997 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.431 ' HD2' HG12 ' A' ' 95' ' ' VAL . 18.8 Cg_endo -58.43 -37.01 96.82 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.506 2.137 . . . . 0.0 112.126 179.75 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 9.9 t -103.31 155.11 18.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.571 179.336 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.995 0 CA-C-O 117.984 -1.008 . . . . 0.0 111.112 -179.649 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 14.8 p . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.761 0.315 . . . . 0.0 111.033 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . 0.461 HG11 ' HE1' ' A' ' 79' ' ' HIS . 1.9 t -89.54 119.4 36.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.03 179.904 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 59.4 mmtt -76.9 100.68 5.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.12 -179.685 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . 0.403 ' HB3' ' O ' ' B' ' 7' ' ' ASN . 3.3 t -93.48 -165.97 1.43 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.866 179.648 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 5' ' ' ASN . . . . . 0.67 ' HB2' HG12 ' A' ' 75' ' ' VAL . 39.2 m-20 -105.49 -59.46 1.76 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.874 179.775 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.748 ' HB3' HD11 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -74.15 -87.87 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.408 179.349 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . 0.799 HD22 ' H ' ' B' ' 9' ' ' ASN . 0.2 OUTLIER -74.41 131.5 80.23 Favored Pre-proline 0 C--N 1.332 -0.176 0 CA-C-N 116.616 -0.265 . . . . 0.0 110.546 178.714 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.516 ' HD2' ' ND2' ' B' ' 7' ' ' ASN . 71.9 Cg_endo -75.24 -3.91 14.59 Favored 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.109 1.872 . . . . 0.0 112.096 179.262 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 9' ' ' ASN . . . . . 0.799 ' H ' HD22 ' B' ' 7' ' ' ASN . 71.8 m-80 -123.35 49.8 1.65 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.657 179.543 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . 0.704 ' HB1' ' HB2' ' A' ' 46' ' ' MET . . . -54.17 95.0 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.714 -179.283 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.645 ' C ' ' HA ' ' A' ' 46' ' ' MET . 6.0 mttp -109.57 124.26 50.82 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.704 179.288 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . 0.674 ' HG2' ' HE3' ' A' ' 42' ' ' LYS . 51.6 mt-10 -47.48 173.01 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -177.895 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 13' ' ' PHE . . . . . 0.788 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.4 OUTLIER -87.41 77.78 8.81 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.352 -179.929 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.593 ' H ' ' CD ' ' B' ' 15' ' ' PRO . 3.5 m -116.16 -31.78 0.09 OUTLIER Pre-proline 0 CA--C 1.54 0.571 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 -177.359 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 15' ' ' PRO . . . . . 0.593 ' CD ' ' H ' ' B' ' 14' ' ' VAL . 50.3 Cg_exo -54.7 -40.67 83.42 Favored 'Trans proline' 0 C--N 1.357 1.006 0 C-N-CA 121.693 1.595 . . . . 0.0 112.378 -179.197 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 83.73 -31.91 3.25 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.375 -179.694 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 34.9 m -94.91 -172.44 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.713 0.292 . . . . 0.0 110.781 179.643 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.86 91.95 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.907 0.384 . . . . 0.0 110.735 179.937 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.488 ' CG ' ' HG2' ' B' ' 15' ' ' PRO . 1.7 t80 -82.79 103.01 11.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.055 -179.35 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 93.51 76.18 1.32 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.558 -179.948 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 10.3 p-10 -100.26 -14.67 18.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.792 0.33 . . . . 0.0 110.909 179.911 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 6.0 tt . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.279 -0.867 . . . . 0.0 111.024 -179.982 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.116 0 CA-C-O 120.185 -0.23 . . . . 0.0 112.529 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.457 ' HG2' HD22 ' A' ' 3' ' ' LEU . 61.1 Cg_endo -73.15 -3.76 14.22 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.544 2.163 . . . . 0.0 112.347 -179.913 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.457 HD22 ' HG2' ' A' ' 2' ' ' PRO . 3.7 mm? -98.28 51.35 1.01 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.861 -179.994 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -84.04 58.79 5.0 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.577 -179.759 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -92.29 -50.76 0.29 Allowed Pre-proline 0 CA--C 1.533 0.325 0 N-CA-C 111.373 0.138 . . . . 0.0 111.373 179.873 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -63.04 -8.25 13.58 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 122.249 1.966 . . . . 0.0 112.393 -179.812 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.46 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.5 OUTLIER -81.78 45.1 0.87 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.06 -179.858 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.835 HG21 ' HB3' ' A' ' 29' ' ' PHE . 1.8 t -87.95 -33.04 18.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.469 -179.693 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.408 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.26 -37.06 76.67 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 177.237 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.4 t -69.08 -35.54 76.61 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.659 177.014 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.722 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 6.2 mtm -64.17 -36.47 84.16 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.886 177.669 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.755 HD11 ' HB3' ' A' ' 24' ' ' LEU . 2.4 mp -52.27 -48.94 65.0 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.156 179.356 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.02 -31.09 71.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.129 178.903 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 56.8 m -101.44 15.47 28.73 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.757 -178.882 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.591 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -136.44 123.14 14.02 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.031 179.967 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -62.58 168.69 9.51 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.521 2.147 . . . . 0.0 111.826 179.356 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -52.76 -43.36 56.44 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.404 2.07 . . . . 0.0 112.366 179.984 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.13 -16.22 51.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.547 -179.549 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.691 ' HG3' ' HB3' ' A' ' 22' ' ' GLN . 4.6 tp10 -86.22 12.35 10.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.081 -179.478 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.436 ' O ' HD23 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -52.83 -60.08 3.7 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.345 -179.868 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.526 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.86 -20.54 15.91 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.496 -178.171 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.691 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -73.2 -79.98 0.07 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.908 0.385 . . . . 0.0 111.425 179.317 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.671 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.55 -94.39 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.687 -176.979 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.755 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -62.11 -1.56 0.73 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -175.291 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.55 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.87 -116.71 9.27 Favored Glycine 0 N--CA 1.444 -0.794 0 N-CA-C 108.427 -1.869 . . . . 0.0 108.427 -174.268 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.424 ' O ' HD13 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -76.63 -69.63 0.5 Allowed 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 169.43 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.914 ' HG2' HD22 ' A' ' 59' ' ' LEU . 1.3 tpt180 -159.86 12.46 0.13 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.318 -1.31 . . . . 0.0 107.985 176.09 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.565 HD12 HD11 ' A' ' 32' ' ' ILE . 3.6 mm? -57.54 -76.06 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.488 -1.233 . . . . 0.0 113.606 -173.243 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.835 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -41.0 -46.65 6.97 Favored Pre-proline 0 C--N 1.325 -0.495 0 N-CA-C 113.728 1.01 . . . . 0.0 113.728 -174.653 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.602 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 50.4 Cg_exo -57.53 -43.83 47.55 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.236 1.957 . . . . 0.0 113.818 -178.216 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.851 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.7 -48.83 52.62 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.228 -178.066 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.84 HG21 HD12 ' A' ' 43' ' ' ILE . 0.9 OUTLIER -73.43 -14.52 16.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.522 179.15 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.626 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.7 OUTLIER -60.88 -42.33 97.76 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 177.03 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.65 -30.02 70.66 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.143 174.902 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.507 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 6.3 mtt -101.41 26.79 6.84 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.657 178.576 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.626 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.4 p-80 -66.04 -32.37 5.61 Favored Pre-proline 0 CA--C 1.537 0.46 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -177.457 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.615 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 44.0 Cg_exo -34.11 -35.9 0.09 OUTLIER 'Trans proline' 0 C--N 1.363 1.318 0 C-N-CA 122.383 2.055 . . . . 0.0 112.466 179.457 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.448 ' HB ' ' H ' ' A' ' 39' ' ' LEU . 1.8 m -78.76 -84.13 0.08 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.816 176.891 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.812 ' HB3' HD22 ' A' ' 76' ' ' LEU . 0.6 OUTLIER -171.36 63.54 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.396 178.212 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.563 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -50.09 -38.29 37.86 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.888 0.375 . . . . 0.0 111.398 179.516 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.582 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -47.94 -47.94 25.24 Favored Glycine 0 CA--C 1.517 0.197 0 CA-C-N 115.782 -0.645 . . . . 0.0 114.13 -178.227 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.616 ' HE3' ' HG3' ' B' ' 12' ' ' GLU . 2.2 tptm -77.74 -42.59 33.66 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -177.192 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.921 HG21 ' HB1' ' A' ' 72' ' ' ALA . 20.3 mt -53.51 -56.51 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 C-N-CA 120.761 -0.376 . . . . 0.0 111.288 -178.267 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.573 HG21 ' CD2' ' A' ' 29' ' ' PHE . 9.8 t -47.04 -46.92 22.49 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 179.234 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.921 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -51.57 -67.51 1.96 Allowed Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 115.33 -0.85 . . . . 0.0 113.212 179.352 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.618 ' HA ' ' C ' ' B' ' 11' ' ' LYS . 0.0 OUTLIER -55.57 -57.75 10.65 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -177.246 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.814 HD23 ' HB2' ' B' ' 7' ' ' ASN . 3.5 mp -79.39 14.52 1.54 Allowed 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -177.068 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.513 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.71 -10.51 47.48 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.235 0.54 . . . . 0.0 109.543 176.359 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.496 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 3.5 mt-10 -80.17 19.89 0.7 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.711 178.96 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.462 HG12 ' HG2' ' A' ' 54' ' ' GLU . 1.3 tt -83.31 162.64 3.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.021 -179.236 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.46 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 4.0 m-20 -70.66 156.78 39.03 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.946 0.403 . . . . 0.0 111.72 -178.449 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.943 ' HA ' HD23 ' A' ' 55' ' ' LEU . 6.5 m120 -84.09 -30.11 26.26 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.21 178.312 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 8.4 t -73.9 -34.03 64.25 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.369 0.604 . . . . 0.0 109.53 177.342 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.462 ' HG2' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -75.84 -28.54 58.28 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.52 179.147 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.943 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -59.59 -46.54 88.63 Favored 'General case' 0 CA--C 1.522 -0.128 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.298 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.646 ' HA ' HD21 ' A' ' 59' ' ' LEU . 61.7 tp -57.83 -49.39 76.83 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.072 -179.678 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.469 ' O ' ' HB2' ' A' ' 61' ' ' SER . 19.3 m-70 -58.78 -21.61 56.33 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.806 -178.992 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.606 ' HE2' ' HA ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -76.17 -57.99 3.54 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -177.742 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.914 HD22 ' HG2' ' A' ' 27' ' ' ARG . 2.2 pt? -65.73 -6.86 12.88 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.538 -0.465 . . . . 0.0 111.098 -178.864 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -105.98 -9.43 17.07 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.94 0.4 . . . . 0.0 110.634 177.745 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.587 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -122.66 97.93 43.82 Favored Pre-proline 0 C--N 1.331 -0.199 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.099 179.61 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -64.94 -30.07 57.55 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.188 1.925 . . . . 0.0 111.924 179.114 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.451 ' O ' ' HB2' ' A' ' 67' ' ' SER . 3.2 mm-40 -78.31 -51.77 9.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.615 -179.75 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.416 ' HB3' ' HB3' ' A' ' 61' ' ' SER . 47.3 t -69.23 -40.29 78.01 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.887 -177.819 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.851 HD21 HD13 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -77.95 -65.14 1.01 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.177 -176.179 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.686 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -51.06 -33.7 26.83 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.885 -0.326 . . . . 0.0 111.524 -176.797 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.471 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 2.9 m -69.97 -35.84 74.75 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.001 0.429 . . . . 0.0 110.195 178.286 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.33 -52.34 48.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.304 178.717 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.615 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 55.4 t -70.37 -16.37 19.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.484 179.127 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.608 ' O ' HG22 ' A' ' 73' ' ' VAL . 20.1 t0 -58.56 -49.05 78.84 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 176.554 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.54 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 2.4 tp10 -68.7 -21.86 64.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.59 176.258 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.921 ' HB1' HG21 ' A' ' 43' ' ' ILE . . . -64.18 -45.38 88.66 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.633 179.353 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.608 HG22 ' O ' ' A' ' 70' ' ' ASP . 2.2 m -59.66 -29.77 43.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 176.852 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.54 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -67.76 -25.18 65.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.91 178.398 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.752 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.3 m -69.89 -32.72 52.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 178.723 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.812 HD22 ' HB3' ' A' ' 39' ' ' LEU . 8.0 mt -70.98 -57.67 4.32 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.956 179.09 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.529 ' HG3' ' O ' ' A' ' 74' ' ' ALA . 0.0 OUTLIER -51.27 -35.58 38.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.047 179.976 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.16 -26.49 36.01 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.791 177.775 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.495 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 23.4 t-80 -65.41 -57.48 8.23 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.847 179.94 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -68.94 -13.7 62.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.184 -179.775 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -67.06 -63.37 1.07 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.422 -179.288 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 17.5 mtmt -79.87 -8.21 59.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.424 -178.977 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.495 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 17.8 tp10 -83.53 -43.94 15.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.832 0.348 . . . . 0.0 110.982 -179.945 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -78.74 0.19 27.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.08 -179.909 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -78.08 -52.87 8.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.044 -179.942 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 28.4 mm-40 -83.87 -71.5 0.5 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.895 -179.981 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -79.31 96.76 6.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.886 179.978 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -75.72 82.35 2.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.157 -179.955 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 8.7 p -94.44 -21.36 5.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.938 179.921 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -80.74 142.3 33.96 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.025 179.902 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 32.8 m -76.11 -41.27 50.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.884 -179.93 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -90.68 96.45 10.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.144 -179.96 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 3.0 p -101.98 -63.39 1.16 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.875 179.987 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -94.56 75.07 0.99 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.88 -0.676 . . . . 0.0 112.432 179.867 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 15.2 m -99.07 148.68 34.93 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 120.612 0.244 . . . . 0.0 111.083 -179.898 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -56.93 142.59 93.42 Favored 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.578 2.185 . . . . 0.0 112.32 -179.804 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.1 m -91.84 119.05 31.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.796 179.745 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.3 p . . . . . 0 C--O 1.248 1.019 0 CA-C-O 117.989 -1.005 . . . . 0.0 111.085 -179.799 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 2.5 t . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.783 0.325 . . . . 0.0 110.951 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 2.0 t -84.3 157.92 3.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.042 -179.956 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.81 22.47 4.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.856 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . 0.444 ' HB3' ' HB2' ' B' ' 10' ' ' ALA . 0.9 OUTLIER -93.19 158.82 15.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.089 -179.808 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -113.76 -58.58 2.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.943 179.967 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.42 HD13 ' HA ' ' B' ' 6' ' ' LEU . 0.0 OUTLIER -66.23 -79.16 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.943 179.829 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . 0.814 ' HB2' HD23 ' A' ' 47' ' ' LEU . 2.2 t30 -84.16 127.05 68.21 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.051 -179.841 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -78.65 5.03 5.88 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.236 1.957 . . . . 0.0 111.899 178.593 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -123.54 43.02 3.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.917 179.945 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . 0.555 ' HB1' ' HB2' ' A' ' 46' ' ' MET . . . -59.78 85.26 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.702 -179.768 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.618 ' C ' ' HA ' ' A' ' 46' ' ' MET . 0.4 OUTLIER -117.61 128.13 54.63 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.051 178.537 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . 0.616 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 6.2 tt0 -46.56 167.47 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -175.846 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 13' ' ' PHE . . . . . 0.921 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.4 OUTLIER -87.41 90.16 8.26 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.206 -0.906 . . . . 0.0 109.91 179.605 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.614 ' H ' ' HD2' ' B' ' 15' ' ' PRO . 4.0 t -124.66 -52.68 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.331 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -177.388 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 15' ' ' PRO . . . . . 0.614 ' HD2' ' H ' ' B' ' 14' ' ' VAL . 94.8 Cg_exo -44.98 -36.08 10.87 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 122.382 2.055 . . . . 0.0 112.678 -178.861 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . 0.485 ' O ' ' HB2' ' A' ' 21' ' ' LYS . . . 76.06 -14.82 5.81 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.412 -179.929 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 2.9 m -96.3 -174.83 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.57 0.224 . . . . 0.0 110.618 179.358 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.479 ' HG3' HD22 ' B' ' 21' ' ' ASN . 0.0 OUTLIER -60.1 89.31 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.956 0.408 . . . . 0.0 110.724 179.984 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.468 ' CE1' ' HG2' ' B' ' 15' ' ' PRO . 0.1 OUTLIER -75.66 118.78 18.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.974 -179.351 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 78.76 53.19 4.69 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.458 -179.964 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . 0.479 HD22 ' HG3' ' B' ' 18' ' ' LYS . 2.7 t-20 -98.3 -65.98 0.93 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.09 0.472 . . . . 0.0 111.068 -179.871 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 5.9 pt . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.217 -0.896 . . . . 0.0 111.03 -179.977 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.177 0 N-CA-C 112.497 -0.241 . . . . 0.0 112.497 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -69.83 -23.25 30.67 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.451 2.101 . . . . 0.0 112.274 179.921 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.35 89.45 7.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.863 179.992 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -80.1 78.87 1.77 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.531 -179.948 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.664 ' HB3' ' HD3' ' A' ' 6' ' ' PRO . 33.8 t -82.35 -50.91 0.78 Allowed Pre-proline 0 CA--C 1.533 0.298 0 N-CA-C 111.342 0.127 . . . . 0.0 111.342 -179.998 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.664 ' HD3' ' HB3' ' A' ' 5' ' ' SER . 24.2 Cg_exo -64.22 105.05 0.55 Allowed 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 122.222 1.948 . . . . 0.0 112.346 -179.872 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.437 ' O ' ' HG3' ' A' ' 11' ' ' MET . 2.9 mm? -90.03 -65.1 1.05 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.619 179.413 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.785 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 8.9 t -87.99 -29.17 20.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.07 179.433 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.46 -39.47 83.76 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 176.41 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 7.3 t -67.97 -34.62 76.89 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.734 177.111 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.785 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 9.2 mtm -64.43 -39.18 93.35 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.224 178.07 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.833 HD21 ' HB3' ' A' ' 24' ' ' LEU . 38.5 mt -52.27 -45.91 65.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.406 -179.9 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.15 -33.66 76.28 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.02 178.439 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.9 m -101.52 19.95 16.97 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.559 -179.098 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.454 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -136.52 114.13 10.34 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.096 -179.97 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.422 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 53.8 Cg_exo -52.72 167.73 0.57 Allowed 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.65 2.233 . . . . 0.0 112.345 179.733 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_exo -57.08 -31.04 89.1 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.542 2.161 . . . . 0.0 112.62 -179.527 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -73.98 -8.26 55.46 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.193 -179.581 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.469 ' O ' ' HB3' ' A' ' 22' ' ' GLN . 0.3 OUTLIER -87.53 13.16 10.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.158 -179.553 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.499 HE21 ' HB2' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -46.74 -68.77 0.16 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.351 179.853 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.545 ' HD3' ' N ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -55.54 -20.23 12.5 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.775 -177.195 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.545 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 14.9 tt0 -73.35 -80.05 0.07 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.963 0.411 . . . . 0.0 111.533 179.153 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.624 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.85 -94.14 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 -176.775 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.833 ' HB3' HD21 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -61.63 1.6 0.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -174.98 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.642 ' CA ' HD21 ' A' ' 48' ' ' LEU . . . 65.1 -117.52 10.47 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 108.598 -1.801 . . . . 0.0 108.598 -174.856 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.492 ' HG2' HG22 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -75.42 -67.25 0.68 Allowed 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 168.985 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.947 ' HG3' HD21 ' A' ' 31' ' ' LEU . 8.7 tpt180 -160.3 6.04 0.08 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.188 -1.369 . . . . 0.0 107.862 174.859 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.825 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.4 OUTLIER -60.01 -75.29 0.06 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.235 -1.348 . . . . 0.0 114.582 -172.175 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.496 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.2 OUTLIER -32.86 -50.81 0.63 Allowed Pre-proline 0 N--CA 1.468 0.468 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -175.484 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.615 ' HG2' ' O ' ' A' ' 27' ' ' ARG . 16.9 Cg_endo -60.25 -40.27 60.72 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 122.132 1.888 . . . . 0.0 113.167 -178.413 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.947 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.16 -48.42 51.97 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.136 179.844 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.726 HD11 HD23 ' A' ' 28' ' ' LEU . 0.9 OUTLIER -68.47 -20.61 25.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.229 -0.442 . . . . 0.0 109.892 178.045 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.658 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -63.44 -32.31 73.72 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 176.839 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.71 -26.04 63.22 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 174.903 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.465 ' HE1' ' HB ' ' A' ' 69' ' ' VAL . 10.2 mtt -102.03 14.07 32.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.559 -1.2 . . . . 0.0 109.749 177.471 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.788 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 0.0 OUTLIER -62.51 -36.39 26.91 Favored Pre-proline 0 CA--C 1.533 0.293 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.946 -179.388 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.788 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 1.3 Cg_endo -42.5 -26.98 0.67 Allowed 'Trans proline' 0 C--N 1.362 1.246 0 C-N-CA 121.969 1.779 . . . . 0.0 110.691 177.435 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.522 HG21 HG11 ' A' ' 73' ' ' VAL . 0.9 OUTLIER -81.93 -82.12 0.14 Allowed 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.37 175.376 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.439 ' H ' ' HB ' ' A' ' 38' ' ' THR . 0.2 OUTLIER -172.19 65.69 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 178.347 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.477 ' HA ' HD12 ' A' ' 43' ' ' ILE . . . -64.15 -172.52 0.07 Allowed 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 176.098 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.807 ' O ' HG22 ' A' ' 44' ' ' THR . . . 108.38 -106.75 2.38 Favored Glycine 0 C--O 1.227 -0.335 0 C-N-CA 120.172 -1.014 . . . . 0.0 113.056 179.476 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.469 ' HA ' ' HD3' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -56.8 -22.51 36.72 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.659 0.266 . . . . 0.0 111.622 -178.077 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.654 HG12 ' HB2' ' A' ' 76' ' ' LEU . 40.7 mt -54.09 -46.2 66.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.76 0.314 . . . . 0.0 110.934 179.684 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.825 ' HA ' HD22 ' A' ' 28' ' ' LEU . 15.4 t -57.14 -44.81 83.74 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.264 -179.606 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -49.36 -43.53 34.79 Favored Glycine 0 CA--C 1.519 0.288 0 C-N-CA 121.2 -0.524 . . . . 0.0 113.766 -178.305 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.514 ' H ' ' HG2' ' A' ' 46' ' ' MET . 0.0 OUTLIER -76.1 -51.9 11.27 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -177.54 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.766 ' HB2' HD21 ' A' ' 28' ' ' LEU . 2.8 mm? -79.67 -0.05 32.35 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.985 -178.693 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.642 HD21 ' CA ' ' A' ' 25' ' ' GLY . 0.2 OUTLIER -66.19 -15.68 63.35 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 121.381 0.61 . . . . 0.0 109.938 177.66 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.549 ' HG2' ' HZ2' ' B' ' 11' ' ' LYS . 0.6 OUTLIER -74.6 17.08 0.22 Allowed 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.572 179.233 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.625 HD11 ' HE3' ' A' ' 68' ' ' LYS . 1.2 tt -84.59 170.35 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.75 179.368 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.624 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 6.9 m-20 -71.56 147.18 47.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.913 0.387 . . . . 0.0 111.721 179.993 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.776 ' HA ' HD23 ' A' ' 55' ' ' LEU . 2.1 t-20 -78.56 -30.84 47.04 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 176.771 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.568 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 0.6 OUTLIER -74.14 -30.46 62.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.395 0.617 . . . . 0.0 109.825 177.234 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.624 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -79.22 -22.67 44.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.364 179.068 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.883 HD13 ' HB2' ' A' ' 27' ' ' ARG . 0.6 OUTLIER -63.53 -47.82 80.07 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.392 179.258 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.661 ' HA ' HD11 ' A' ' 59' ' ' LEU . 2.3 pp -61.29 -41.45 96.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.907 0.384 . . . . 0.0 110.266 179.455 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.0 -13.09 56.96 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.947 178.78 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.583 ' HB2' ' O ' ' A' ' 55' ' ' LEU . 22.4 mmt -76.45 -57.38 3.9 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.473 -179.494 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.881 HD13 ' H ' ' A' ' 59' ' ' LEU . 0.0 OUTLIER -64.3 -10.79 26.33 Favored 'General case' 0 N--CA 1.463 0.176 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.206 179.286 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.54 ' N ' HD22 ' A' ' 59' ' ' LEU . 2.6 tp10 -92.44 -19.12 22.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.276 178.186 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.634 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 1.3 t -122.78 88.48 50.22 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.917 179.369 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -62.5 -31.27 80.42 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.281 1.987 . . . . 0.0 112.202 179.803 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -77.8 -48.44 16.56 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.424 -179.653 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.44 ' O ' ' HB2' ' A' ' 67' ' ' SER . 16.9 m -68.95 -47.73 64.94 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.027 0.442 . . . . 0.0 111.093 -178.935 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.703 ' CD1' HD13 ' A' ' 31' ' ' LEU . 0.6 OUTLIER -57.93 -64.17 1.0 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.749 -0.66 . . . . 0.0 112.01 -178.575 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.625 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.9 OUTLIER -49.03 -32.24 9.03 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.233 -177.084 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.501 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 5.1 m -58.71 -45.27 89.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.163 0.506 . . . . 0.0 110.196 178.233 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.625 ' HE3' HD11 ' A' ' 50' ' ' ILE . 12.3 mtmm -65.48 -64.47 0.85 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.716 179.472 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.517 HG11 HG12 ' A' ' 32' ' ' ILE . 82.8 t -57.52 -20.16 13.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.358 -178.8 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.501 ' HB3' ' O ' ' A' ' 67' ' ' SER . 5.9 t70 -55.92 -51.3 68.11 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 176.468 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.442 ' O ' HG13 ' A' ' 75' ' ' VAL . 1.0 OUTLIER -68.95 -29.17 67.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.827 177.049 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.651 ' O ' HG22 ' A' ' 75' ' ' VAL . . . -58.61 -40.98 84.81 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.32 178.543 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.621 ' HA ' HD13 ' A' ' 43' ' ' ILE . 24.8 t -62.24 -32.22 54.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 177.061 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.408 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -70.52 -38.63 74.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.289 179.394 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.651 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.9 -27.96 36.86 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 CA-C-O 120.995 0.426 . . . . 0.0 110.337 179.556 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.654 ' HB2' HG12 ' A' ' 43' ' ' ILE . 2.8 tm? -71.07 -48.76 50.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.317 178.865 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -60.1 -33.24 71.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.711 179.914 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.89 -20.08 42.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.871 179.138 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.453 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 12.4 t-80 -63.1 -61.67 2.22 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.879 -179.93 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -71.88 -10.34 59.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.085 -179.991 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -75.68 -56.59 4.54 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.317 -179.617 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.27 -12.89 59.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.352 -179.263 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.453 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 0.9 OUTLIER -86.09 -49.57 7.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.057 -179.641 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -76.86 2.36 14.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.163 -179.877 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.63 -24.01 66.94 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.06 179.897 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -78.37 -32.66 49.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.938 179.933 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -93.64 38.73 1.06 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.862 179.938 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -85.54 37.98 0.72 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.115 -179.919 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.2 t -78.76 133.31 30.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.131 -179.88 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -84.07 -51.79 6.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.833 179.91 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -90.58 76.29 6.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.811 179.777 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -79.21 -61.11 2.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.998 179.942 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 14.7 p -96.74 158.71 15.3 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.826 179.981 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -87.05 -40.08 7.18 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.462 179.99 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.8 t -107.28 115.93 58.94 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 120.584 0.23 . . . . 0.0 111.094 -179.928 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -79.06 65.02 8.9 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.626 2.217 . . . . 0.0 112.392 179.874 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.84 HG23 HG22 ' A' ' 98' ' ' VAL . 2.4 t -81.32 -35.28 31.16 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.93 -179.891 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.84 HG22 HG23 ' A' ' 97' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.005 0 CA-C-O 117.925 -1.036 . . . . 0.0 110.979 179.885 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 1.6 m . . . . . 0 N--CA 1.487 1.415 0 CA-C-O 120.813 0.339 . . . . 0.0 110.963 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . 0.436 HG22 ' O ' ' B' ' 2' ' ' VAL . 7.2 p -93.25 36.62 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.399 0.618 . . . . 0.0 110.824 -179.894 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 10.2 mttt -85.49 52.9 2.58 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.078 179.812 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . 0.492 ' HB2' ' HB2' ' B' ' 10' ' ' ALA . 4.9 t -85.79 173.57 9.95 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.909 179.905 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -108.49 -47.71 3.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.923 -179.981 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.586 HD11 ' O ' ' A' ' 68' ' ' LYS . 35.7 mt -75.98 -79.28 0.1 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.933 -179.97 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . 0.72 HD22 ' H ' ' B' ' 9' ' ' ASN . 0.5 OUTLIER -79.49 127.76 77.33 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.273 -179.36 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.511 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 5.9 Cg_exo -79.76 0.43 10.03 Favored 'Trans proline' 0 N--CA 1.459 -0.508 0 C-N-CA 122.744 2.296 . . . . 0.0 112.072 179.502 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 9' ' ' ASN . . . . . 0.72 ' H ' HD22 ' B' ' 7' ' ' ASN . 44.0 m-20 -123.51 48.82 1.79 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.877 179.845 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . 0.51 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.89 99.13 0.08 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.081 -0.508 . . . . 0.0 112.068 -179.697 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.549 ' HZ2' ' HG2' ' A' ' 49' ' ' GLU . 0.1 OUTLIER -128.0 -178.37 4.49 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 120.776 0.322 . . . . 0.0 110.987 177.432 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -68.61 176.98 2.65 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 121.001 0.429 . . . . 0.0 111.459 -179.55 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 13' ' ' PHE . . . . . 0.421 ' CD1' HD13 ' A' ' 48' ' ' LEU . 1.0 OUTLIER -93.51 112.37 24.25 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.13 178.053 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 3.0 m -112.97 87.43 10.37 Favored Pre-proline 0 C--N 1.327 -0.396 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.487 179.322 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 15' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -55.82 -167.13 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 123.048 2.499 . . . . 0.0 113.08 -178.52 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . 0.459 ' O ' ' HE3' ' A' ' 21' ' ' LYS . . . 85.07 -56.08 4.98 Favored Glycine 0 N--CA 1.451 -0.336 0 CA-C-N 115.628 -0.714 . . . . 0.0 112.267 -179.297 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 15.7 m -115.94 157.7 16.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.805 0.336 . . . . 0.0 111.321 179.802 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.494 ' HG3' HE22 ' A' ' 20' ' ' GLN . 3.9 mtpp -68.99 92.92 0.54 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.464 178.877 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.426 ' OH ' ' HG3' ' B' ' 11' ' ' LYS . 0.3 OUTLIER -65.06 125.38 24.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.831 0.348 . . . . 0.0 110.738 -179.837 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . 0.508 ' HA3' ' HA ' ' A' ' 49' ' ' GLU . . . 93.9 41.23 4.42 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.285 -179.13 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -88.73 116.17 26.8 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.79 0.329 . . . . 0.0 110.973 -179.902 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 12.6 mt . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.265 -0.874 . . . . 0.0 111.064 -179.873 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.19 0 CA-C-O 120.173 -0.237 . . . . 0.0 112.528 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -74.68 165.38 85.8 Favored 'Cis proline' 0 C--N 1.349 0.584 0 C-N-CA 123.627 -1.405 . . . . 0.0 112.207 0.494 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -83.22 -57.71 3.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.951 179.999 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -105.13 68.32 0.26 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.439 179.942 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.4 t -84.1 122.76 75.89 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 120.624 0.25 . . . . 0.0 110.915 -179.761 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -69.98 79.89 0.98 Allowed 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.457 2.104 . . . . 0.0 112.226 179.638 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.453 ' HB3' ' H ' ' A' ' 8' ' ' THR . 4.8 mt -95.7 -147.96 0.29 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.753 -179.904 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.801 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 13.1 t -87.97 -29.65 20.62 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 179.99 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.434 ' HB2' ' OE1' ' A' ' 33' ' ' GLN . . . -59.45 -35.66 74.48 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 176.869 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 26.8 t -72.96 -34.83 66.74 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.849 177.572 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.801 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 4.8 mtm -64.33 -38.72 92.04 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.013 178.189 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.815 HD21 ' HB3' ' A' ' 24' ' ' LEU . 37.3 mt -52.61 -51.29 60.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.099 179.37 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.25 -28.14 68.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.827 177.953 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.66 20.46 16.15 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.77 -178.702 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.697 ' HB1' ' CB ' ' A' ' 19' ' ' GLU . . . -134.44 59.84 39.15 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 120.612 0.244 . . . . 0.0 111.12 -179.924 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.483 ' HD3' ' N ' ' A' ' 15' ' ' ALA . 48.5 Cg_exo -57.3 -49.46 13.82 Favored 'Trans proline' 0 CA--C 1.537 0.647 0 C-N-CA 122.69 2.26 . . . . 0.0 113.964 -178.406 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.474 ' HD2' ' N ' ' A' ' 16' ' ' PRO . 43.2 Cg_endo -67.36 -162.36 0.07 OUTLIER 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 121.963 1.776 . . . . 0.0 112.544 -178.993 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.45 71.12 1.29 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.85 179.744 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.697 ' CB ' ' HB1' ' A' ' 15' ' ' ALA . 0.4 OUTLIER -104.18 5.2 34.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.871 -179.546 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -46.05 -65.73 0.51 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.375 -178.651 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.78 ' HD2' ' HA ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER -55.76 -24.88 37.92 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.265 -178.79 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.426 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 6.6 tp60 -73.62 -77.36 0.11 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.736 0.303 . . . . 0.0 111.648 179.164 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.728 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -67.24 -97.06 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 112.543 0.571 . . . . 0.0 112.543 -176.375 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.898 HD12 ' HD3' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -62.09 1.07 0.33 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 113.604 0.965 . . . . 0.0 113.604 -175.525 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.695 ' HA3' HD21 ' A' ' 48' ' ' LEU . . . 64.71 -118.47 12.55 Favored Glycine 0 N--CA 1.445 -0.757 0 N-CA-C 108.435 -1.866 . . . . 0.0 108.435 -174.865 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 51' ' ' ASP . 1.8 mp0 -75.78 -68.45 0.57 Allowed 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 168.831 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.898 ' HD3' HD12 ' A' ' 24' ' ' LEU . 8.4 tpt85 -160.24 13.26 0.12 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 113.986 -1.461 . . . . 0.0 107.814 174.59 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.807 HD12 ' HA ' ' A' ' 44' ' ' THR . 1.4 mm? -56.98 -80.23 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 114.568 -1.196 . . . . 0.0 113.627 -173.125 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.8 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -36.14 -49.78 1.67 Allowed Pre-proline 0 CA--C 1.537 0.447 0 N-CA-C 113.626 0.972 . . . . 0.0 113.626 -174.501 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.75 ' HB2' ' NH1' ' A' ' 27' ' ' ARG . 50.6 Cg_exo -58.03 -40.92 73.4 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.209 1.939 . . . . 0.0 113.938 -177.852 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.815 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.86 -47.24 60.37 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 120.343 -0.543 . . . . 0.0 109.906 -179.195 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.546 ' O ' ' HB2' ' A' ' 40' ' ' ALA . 0.3 OUTLIER -74.14 -13.52 15.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.049 178.5 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.634 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 1.5 tt0 -61.46 -42.01 98.1 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 108.55 -0.908 . . . . 0.0 108.55 177.357 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.93 -30.2 70.27 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.077 174.958 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.526 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 6.7 mtt -100.25 26.11 6.88 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.52 178.364 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.634 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 1.6 p-80 -63.81 -32.82 8.49 Favored Pre-proline 0 CA--C 1.537 0.445 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -177.726 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.616 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 49.2 Cg_exo -34.56 -35.49 0.1 OUTLIER 'Trans proline' 0 C--N 1.363 1.324 0 C-N-CA 122.316 2.011 . . . . 0.0 112.258 178.897 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.416 ' HB ' ' H ' ' A' ' 39' ' ' LEU . 13.2 m -77.9 -86.11 0.06 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.631 176.547 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.75 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -171.58 65.22 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.302 178.003 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.546 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -49.78 -33.67 17.1 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.452 179.655 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.592 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -50.5 -56.3 13.7 Favored Glycine 0 C--N 1.33 0.201 0 CA-C-N 115.973 -0.558 . . . . 0.0 114.046 -178.294 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.567 ' HE2' ' SD ' ' A' ' 46' ' ' MET . 2.0 tptm -77.54 -38.75 48.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 117.128 0.464 . . . . 0.0 111.952 -177.637 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.673 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 18.3 mt -54.33 -56.21 11.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 121.203 -0.199 . . . . 0.0 111.399 -178.698 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.807 ' HA ' HD12 ' A' ' 28' ' ' LEU . 5.8 t -47.69 -47.7 29.57 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 178.552 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.664 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -49.41 -65.48 2.75 Favored Glycine 0 N--CA 1.451 -0.331 0 CA-C-N 115.656 -0.702 . . . . 0.0 113.621 -179.826 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.656 ' HG3' HD12 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -54.48 -71.23 0.08 Allowed 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 -176.599 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.867 HD23 ' HB2' ' B' ' 7' ' ' ASN . 3.7 mp -66.87 6.17 0.54 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -176.621 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.695 HD21 ' HA3' ' A' ' 25' ' ' GLY . 0.2 OUTLIER -66.84 -1.57 4.1 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.051 0.453 . . . . 0.0 110.539 177.125 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.602 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 1.2 mm-40 -81.99 19.08 1.19 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.579 176.716 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.475 HD11 ' HE3' ' A' ' 68' ' ' LYS . 2.0 tt -82.28 165.1 2.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.175 -178.412 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.453 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 34.5 m-20 -70.42 160.95 31.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.731 -178.751 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.81 ' HA ' HD23 ' A' ' 55' ' ' LEU . 5.1 m120 -87.22 -30.29 21.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.872 177.375 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.6 t -73.86 -29.03 61.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.791 177.714 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.434 ' HG3' ' HB2' ' A' ' 51' ' ' ASP . 4.3 mt-10 -79.65 -29.26 40.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.555 178.804 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.81 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.5 OUTLIER -58.88 -46.49 87.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.976 0.417 . . . . 0.0 110.07 179.395 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.486 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 1.9 tm? -62.62 -41.76 99.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.192 178.623 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.502 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 0.9 OUTLIER -60.88 -34.98 75.45 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.537 178.897 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.57 ' HA ' ' HB2' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -68.91 -43.49 75.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.171 178.758 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.621 HD13 ' NH2' ' A' ' 27' ' ' ARG . 5.4 tp -69.79 -15.1 63.06 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.663 179.49 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.502 ' HG2' ' O ' ' A' ' 57' ' ' HIS . 4.6 pt-20 -102.53 -7.92 21.47 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.009 179.456 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.57 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.4 OUTLIER -125.58 89.02 53.26 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.99 179.65 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -61.69 -32.92 86.94 Favored 'Trans proline' 0 C--N 1.343 0.261 0 C-N-CA 122.266 1.977 . . . . 0.0 111.997 179.538 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -78.05 -48.4 16.19 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.489 -179.683 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.413 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 15.5 m -69.37 -52.18 29.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.956 0.408 . . . . 0.0 111.397 -178.641 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.787 HD11 ' HB3' ' A' ' 31' ' ' LEU . 0.1 OUTLIER -58.1 -57.81 11.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.316 -178.53 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.686 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.5 OUTLIER -51.8 -33.81 37.3 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.492 -178.936 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.589 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 3.9 m -69.71 -35.96 75.5 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.142 0.496 . . . . 0.0 110.094 177.818 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.58 ' HG2' HD21 ' B' ' 6' ' ' LEU . 0.1 OUTLIER -66.09 -56.78 9.79 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.992 178.233 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.541 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 49.1 t -67.7 -15.18 19.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.489 178.585 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.655 ' O ' HG22 ' A' ' 73' ' ' VAL . 10.7 t70 -57.62 -49.42 76.49 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 176.362 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.443 ' O ' HG13 ' A' ' 75' ' ' VAL . 22.0 tt0 -68.34 -26.49 65.62 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.44 176.476 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.673 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -62.43 -43.64 98.33 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.183 179.699 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.655 HG22 ' O ' ' A' ' 70' ' ' ASP . 2.8 m -62.7 -30.58 49.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.941 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -68.99 -36.57 77.98 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.037 178.872 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.65 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -60.21 -32.31 50.32 Favored 'Isoleucine or valine' 0 C--O 1.231 0.121 0 CA-C-O 121.025 0.441 . . . . 0.0 110.175 179.218 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.75 ' HG ' ' HB3' ' A' ' 39' ' ' LEU . 2.6 tm? -71.75 -47.93 50.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.203 178.51 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -55.79 -36.99 68.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.51 179.343 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.49 -15.62 54.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.205 179.527 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.479 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 0.1 OUTLIER -64.74 -54.44 31.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.804 0.335 . . . . 0.0 111.024 -179.618 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 11.6 mp0 -62.73 -10.32 12.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.859 -178.828 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -60.21 -68.66 0.27 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.712 0.291 . . . . 0.0 110.96 179.713 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.424 ' HE2' HG11 ' B' ' 2' ' ' VAL . 0.0 OUTLIER -79.48 -12.34 59.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.894 179.689 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.479 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -84.73 -12.59 53.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.809 179.726 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.61 -23.0 67.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.033 179.908 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -72.42 -11.17 60.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.006 179.992 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -91.36 -48.6 6.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.858 -179.982 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt -92.48 109.83 21.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.958 -179.812 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -85.21 84.95 7.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.89 179.648 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -95.06 165.73 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.093 -179.822 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -79.84 -20.07 46.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.925 179.923 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 9.1 t -94.83 57.35 2.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.863 179.994 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -91.79 29.01 1.64 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.094 -179.881 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.19 3.04 51.67 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.946 -179.962 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -81.55 -39.63 12.04 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.492 179.854 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 12.3 m -87.72 151.22 49.81 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 120.462 0.172 . . . . 0.0 111.03 179.913 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -72.26 157.71 97.54 Favored 'Cis proline' 0 C--N 1.349 0.588 0 C-N-CA 123.898 -1.292 . . . . 0.0 112.333 0.77 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 72.7 p -79.82 150.79 30.58 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.909 -179.929 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 27.0 m . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.109 -0.948 . . . . 0.0 111.124 -179.988 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . 0.678 HG11 ' HD3' ' B' ' 11' ' ' LYS . 5.8 m . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.878 0.37 . . . . 0.0 111.102 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . 0.424 HG11 ' HE2' ' A' ' 82' ' ' LYS . 0.1 OUTLIER -99.82 175.94 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.969 179.806 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -94.34 119.09 32.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.968 -179.873 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . 0.497 ' HB2' ' HB2' ' B' ' 10' ' ' ALA . 4.7 t -86.16 -168.8 2.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.92 -179.84 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -108.34 -54.29 2.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.044 -179.62 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.58 HD21 ' HG2' ' A' ' 68' ' ' LYS . 41.7 tp -76.41 -76.31 0.17 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.812 179.995 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . 0.867 ' HB2' HD23 ' A' ' 47' ' ' LEU . 2.1 t30 -83.4 122.27 77.03 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.74 179.341 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.472 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 5.2 Cg_exo -77.61 7.37 3.89 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 122.543 2.162 . . . . 0.0 111.858 179.381 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 9' ' ' ASN . . . . . 0.405 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 4.0 m120 -123.15 38.39 4.2 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.08 -179.593 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . 0.497 ' HB2' ' HB2' ' B' ' 4' ' ' SER . . . -59.57 89.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.852 -179.266 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.678 ' HD3' HG11 ' B' ' 1' ' ' VAL . 1.1 mmtp -125.71 129.96 50.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.828 177.952 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . 0.526 ' HG2' ' NZ ' ' A' ' 42' ' ' LYS . 6.6 mt-10 -46.63 170.72 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -176.282 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 13' ' ' PHE . . . . . 0.664 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.4 OUTLIER -86.45 94.2 9.34 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.163 178.946 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.623 ' H ' ' HD2' ' B' ' 15' ' ' PRO . 42.5 t -130.26 -53.26 0.03 OUTLIER Pre-proline 0 C--N 1.327 -0.397 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -175.992 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 15' ' ' PRO . . . . . 0.623 ' HD2' ' H ' ' B' ' 14' ' ' VAL . 97.3 Cg_exo -44.56 -30.24 3.85 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 122.316 2.011 . . . . 0.0 112.987 -177.784 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . 0.494 ' O ' ' HB2' ' A' ' 21' ' ' LYS . . . 72.59 -13.22 3.07 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.236 -179.56 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.78 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 26.4 m -107.78 -172.09 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.546 0.213 . . . . 0.0 110.452 179.268 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.37 91.52 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.893 0.378 . . . . 0.0 110.839 -179.846 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.449 ' CD1' ' HG2' ' B' ' 15' ' ' PRO . 0.1 OUTLIER -77.89 125.19 28.98 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.996 -179.696 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 88.14 43.05 5.74 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.491 -179.817 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -91.82 109.93 21.27 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.77 0.319 . . . . 0.0 110.961 -179.931 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 7.5 mt . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.238 -0.887 . . . . 0.0 111.087 179.897 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.188 0 CA-C-O 120.097 -0.28 . . . . 0.0 112.481 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -73.2 -47.56 0.31 Allowed 'Cis proline' 0 C--N 1.348 0.508 0 C-N-CA 123.585 -1.423 . . . . 0.0 112.256 0.449 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -90.94 163.36 14.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.859 179.947 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -105.4 61.15 0.37 Allowed Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.502 -179.967 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -89.36 150.41 44.63 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 120.571 0.224 . . . . 0.0 110.9 179.982 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.18 -7.64 17.89 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.564 2.176 . . . . 0.0 112.344 179.958 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.745 HD23 ' HB2' ' A' ' 10' ' ' SER . 1.6 mp -80.86 99.55 8.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.849 179.878 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.761 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 15.1 t -87.71 -35.52 17.9 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.257 -179.681 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.405 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.5 -36.25 75.69 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 176.566 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.745 ' HB2' HD23 ' A' ' 7' ' ' LEU . 16.8 t -67.77 -34.83 77.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.668 177.399 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.761 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 9.6 mtm -64.26 -37.34 87.12 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.006 177.696 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.791 HD11 ' HB3' ' A' ' 24' ' ' LEU . 2.0 mp -51.9 -47.67 64.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.096 179.364 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.26 -34.33 77.76 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.23 178.644 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.2 m -100.36 21.95 12.34 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.631 -178.63 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.691 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -136.92 121.84 12.73 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.012 179.568 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.416 ' HG2' ' OE1' ' A' ' 19' ' ' GLU . 19.1 Cg_endo -57.9 168.7 3.17 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.534 2.156 . . . . 0.0 111.948 179.518 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -56.76 -36.32 98.44 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.499 2.133 . . . . 0.0 112.306 -179.909 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -73.51 -9.19 58.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.152 -179.799 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.691 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 1.2 tp10 -86.27 10.31 15.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.287 -179.486 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.451 HE21 ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -51.02 -59.84 3.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.299 -179.92 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.469 ' H ' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -55.65 -21.47 18.16 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.514 -178.122 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.49 HE21 ' HG3' ' A' ' 23' ' ' MET . 5.4 tt0 -73.2 -79.24 0.08 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.989 0.423 . . . . 0.0 111.512 179.206 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.669 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.32 -94.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.795 -0.638 . . . . 0.0 112.685 -176.935 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.791 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -62.02 -0.81 0.55 Allowed 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.434 0.902 . . . . 0.0 113.434 -175.363 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.533 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.86 -117.18 9.96 Favored Glycine 0 N--CA 1.444 -0.815 0 N-CA-C 108.474 -1.85 . . . . 0.0 108.474 -174.853 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.471 ' O ' HD13 ' A' ' 55' ' ' LEU . 0.7 OUTLIER -76.08 -68.73 0.55 Allowed 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 169.247 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.806 ' HG2' HD12 ' A' ' 59' ' ' LEU . 7.8 tpt180 -160.07 12.84 0.12 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 114.47 -1.241 . . . . 0.0 108.424 175.673 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.568 HD12 HD11 ' A' ' 32' ' ' ILE . 4.0 mm? -57.02 -78.89 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.622 -1.172 . . . . 0.0 113.623 -173.043 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.737 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -36.6 -48.92 1.85 Allowed Pre-proline 0 CA--C 1.537 0.452 0 N-CA-C 113.48 0.919 . . . . 0.0 113.48 -175.062 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.585 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 52.4 Cg_exo -56.62 -43.42 55.26 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.293 1.995 . . . . 0.0 113.719 -178.279 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.767 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.61 -46.08 64.06 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.169 0.509 . . . . 0.0 110.124 -178.242 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.681 HG21 HD12 ' A' ' 43' ' ' ILE . 0.3 OUTLIER -77.72 -12.38 13.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.453 179.105 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.625 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 11.2 tp60 -62.65 -38.67 91.19 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 176.654 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.73 -31.51 70.64 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.053 -0.976 . . . . 0.0 108.967 174.482 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.485 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 7.6 mtt -100.27 27.43 5.68 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.35 178.023 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.814 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 1.7 p-80 -63.63 -32.88 8.78 Favored Pre-proline 0 CA--C 1.536 0.423 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -177.869 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.814 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 3.4 Cg_exo -35.3 -32.82 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.284 0 C-N-CA 122.687 2.258 . . . . 0.0 112.211 179.488 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.402 ' N ' ' O ' ' A' ' 36' ' ' HIS . 45.4 m -78.09 -86.83 0.06 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.101 -0.499 . . . . 0.0 109.811 176.637 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.668 ' O ' HG13 ' A' ' 43' ' ' ILE . 6.1 tp -171.47 56.08 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.512 178.175 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.478 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -39.87 -34.7 0.29 Allowed 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -179.865 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.606 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -48.58 -58.96 6.96 Favored Glycine 0 CA--C 1.519 0.289 0 CA-C-N 116.058 -0.519 . . . . 0.0 114.021 -179.049 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.945 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.3 OUTLIER -77.48 -30.35 53.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 117.068 0.434 . . . . 0.0 111.574 -178.356 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.681 HD12 HG21 ' A' ' 32' ' ' ILE . 5.1 mt -57.19 -58.21 6.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.116 -179.271 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.599 HG21 ' CD2' ' A' ' 29' ' ' PHE . 5.3 t -47.72 -45.89 29.23 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.984 0.421 . . . . 0.0 110.526 178.661 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.744 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -50.86 -66.94 2.16 Favored Glycine 0 N--CA 1.452 -0.279 0 CA-C-N 115.511 -0.768 . . . . 0.0 113.709 -179.28 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.737 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.37 -49.99 70.86 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 117.047 0.423 . . . . 0.0 111.527 -177.744 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.48 HD22 ' N ' ' A' ' 47' ' ' LEU . 2.9 mm? -76.49 3.33 11.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.542 -178.389 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.541 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.29 -10.29 41.08 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.991 0.424 . . . . 0.0 110.55 179.545 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.414 ' HG3' ' O ' ' B' ' 9' ' ' ASN . 3.1 mm-40 -82.39 19.71 1.19 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.508 178.438 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.424 HG23 ' O ' ' A' ' 51' ' ' ASP . 1.1 tt -83.57 164.32 2.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.024 -179.409 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.424 ' O ' HG23 ' A' ' 50' ' ' ILE . 1.0 OUTLIER -70.97 157.95 37.33 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.498 -179.404 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.862 ' HA ' HD23 ' A' ' 55' ' ' LEU . 4.4 m120 -86.1 -29.81 23.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.148 178.14 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -73.32 -33.77 65.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.232 0.539 . . . . 0.0 109.579 177.706 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.425 ' O ' ' SD ' ' A' ' 58' ' ' MET . 3.4 mt-10 -75.73 -29.25 58.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.688 178.945 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.862 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -58.46 -46.8 85.85 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.877 0.37 . . . . 0.0 110.213 -179.922 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.643 ' HA ' HD11 ' A' ' 59' ' ' LEU . 1.6 tt -59.5 -46.01 90.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.759 179.342 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.591 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 1.5 m80 -62.12 -16.91 55.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.548 -179.519 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.561 ' HB3' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -75.88 -56.53 4.59 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 -178.462 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.859 HD13 ' H ' ' A' ' 59' ' ' LEU . 0.0 OUTLIER -64.38 -12.0 38.38 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.269 -0.573 . . . . 0.0 110.678 179.953 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.594 ' N ' HD22 ' A' ' 59' ' ' LEU . 2.4 pt-20 -98.7 -12.29 21.15 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.899 179.283 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.537 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.3 OUTLIER -122.96 92.04 49.42 Favored Pre-proline 0 C--N 1.332 -0.186 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.079 179.886 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.435 ' O ' ' HB2' ' A' ' 66' ' ' ARG . 36.0 Cg_endo -64.49 -31.29 61.24 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.337 2.025 . . . . 0.0 112.009 179.409 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.62 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.63 -47.14 17.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.267 179.895 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.62 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 15.1 m -70.95 -55.55 8.12 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.503 -178.564 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.767 HD21 HD13 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -58.19 -61.52 2.5 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.613 -178.184 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.661 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -50.26 -31.21 13.55 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.94 -178.043 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.522 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.6 OUTLIER -68.17 -40.76 82.2 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.1 0.476 . . . . 0.0 110.294 177.949 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.493 ' HD3' ' CE ' ' A' ' 58' ' ' MET . 30.0 mtpt -65.86 -59.38 3.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.566 179.299 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.527 ' CG1' HG23 ' A' ' 32' ' ' ILE . 44.8 t -60.53 -20.99 22.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.486 179.86 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.598 ' O ' HG22 ' A' ' 73' ' ' VAL . 28.3 t0 -55.61 -48.87 74.18 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.219 -0.659 . . . . 0.0 109.219 176.55 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.594 ' HB3' HD13 ' B' ' 6' ' ' LEU . 1.1 tt0 -68.98 -26.69 65.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.936 176.845 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.675 ' O ' HG22 ' A' ' 75' ' ' VAL . . . -62.35 -53.36 56.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.022 179.871 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.643 ' HA ' HD13 ' A' ' 43' ' ' ILE . 2.8 m -54.23 -29.4 19.34 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 177.356 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.514 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -70.78 -36.43 73.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.466 179.856 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.675 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.5 m -56.23 -28.37 25.6 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 178.673 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.945 HD11 ' HB3' ' A' ' 42' ' ' LYS . 1.6 mm? -71.83 -51.63 21.5 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.126 176.846 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -52.81 -35.16 56.55 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.854 178.507 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.403 ' O ' ' HB3' ' A' ' 81' ' ' ALA . . . -82.29 -21.46 36.15 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.185 178.173 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.469 ' O ' ' HB3' ' A' ' 83' ' ' GLU . 9.4 t-80 -58.84 -63.12 1.41 Allowed 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.886 -179.373 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 58.0 mt-30 -68.28 -3.06 9.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.329 -179.621 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.403 ' HB3' ' O ' ' A' ' 78' ' ' ALA . . . -79.74 -68.69 0.64 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.387 -179.49 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 6.6 mmtm -75.35 -18.02 60.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.586 -178.783 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.469 ' HB3' ' O ' ' A' ' 79' ' ' HIS . 9.2 tp10 -79.9 -50.17 10.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.066 -179.566 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -77.43 -1.77 31.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.185 -179.89 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -71.02 -43.39 68.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.962 179.971 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.16 83.38 6.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.867 -179.915 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.81 7.15 46.86 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.951 179.977 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -88.5 -1.81 58.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.171 -179.659 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.1 p -104.76 130.49 55.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.098 -179.929 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -104.54 125.46 50.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.899 179.884 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.431 ' HB2' ' H ' ' A' ' 92' ' ' ALA . 0.7 OUTLIER -95.11 -88.76 0.25 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.942 -179.989 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.431 ' H ' ' HB2' ' A' ' 91' ' ' SER . . . -92.87 -71.2 0.66 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.112 179.999 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 19.5 p -117.82 -169.98 1.78 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.864 -179.807 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -77.2 -120.4 0.19 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.506 179.984 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.2 m -107.73 122.1 42.02 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 120.625 0.25 . . . . 0.0 111.131 -179.99 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -70.64 78.04 1.34 Allowed 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.763 2.308 . . . . 0.0 112.138 -179.961 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.08 132.39 51.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.849 -179.929 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 1.3 m . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.138 -0.934 . . . . 0.0 111.084 179.813 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 7.2 p . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 120.894 0.378 . . . . 0.0 111.139 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . 0.445 HG21 ' O ' ' B' ' 8' ' ' PRO . 2.2 t -88.83 110.41 21.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.88 179.828 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.91 16.27 18.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.193 -179.354 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 30.3 m -93.65 158.04 15.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.992 179.678 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -103.97 -38.07 7.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.46 179.176 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.594 HD13 ' HB3' ' A' ' 71' ' ' GLU . 1.4 tp -75.23 -81.59 0.07 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.782 179.272 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . 0.593 HD22 ' H ' ' B' ' 9' ' ' ASN . 0.6 OUTLIER -79.83 120.16 79.08 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.193 179.883 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.445 ' O ' HG21 ' B' ' 2' ' ' VAL . 73.6 Cg_endo -76.01 3.09 6.42 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.196 1.93 . . . . 0.0 111.67 178.415 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 9' ' ' ASN . . . . . 0.593 ' H ' HD22 ' B' ' 7' ' ' ASN . 5.4 m120 -123.3 48.09 1.89 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.477 179.354 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . 0.737 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -59.44 96.83 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.801 -179.087 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.511 ' NZ ' ' HB3' ' B' ' 9' ' ' ASN . 8.3 mttp -125.19 133.78 52.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.076 178.189 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . 0.62 ' HG2' ' HE3' ' A' ' 42' ' ' LYS . 44.9 mt-10 -48.29 165.43 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.033 0.444 . . . . 0.0 111.982 -178.591 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 13' ' ' PHE . . . . . 0.744 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.8 OUTLIER -87.32 83.9 7.29 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.435 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.924 ' H ' ' HD2' ' B' ' 15' ' ' PRO . 1.7 m -125.85 -36.02 0.04 OUTLIER Pre-proline 0 CA--C 1.539 0.555 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 -174.648 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 15' ' ' PRO . . . . . 0.924 ' HD2' ' H ' ' B' ' 14' ' ' VAL . 12.1 Cg_endo -54.78 -34.08 83.31 Favored 'Trans proline' 0 C--N 1.355 0.887 0 C-N-CA 121.704 1.603 . . . . 0.0 112.576 -178.07 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . 0.438 ' O ' ' HB2' ' A' ' 21' ' ' LYS . . . 78.45 -23.67 2.81 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.279 -179.505 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.71 HG22 ' H ' ' B' ' 18' ' ' LYS . 2.1 p -94.77 -178.7 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 N-CA-C 110.309 -0.256 . . . . 0.0 110.309 179.403 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.71 ' H ' HG22 ' B' ' 17' ' ' VAL . 0.0 OUTLIER -59.55 94.65 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.891 0.377 . . . . 0.0 110.998 -179.174 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.431 ' CD1' ' HG3' ' B' ' 15' ' ' PRO . 0.1 OUTLIER -79.72 114.42 18.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.823 -179.771 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 89.45 36.31 7.53 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.282 -179.339 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -83.6 94.13 8.02 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.763 0.316 . . . . 0.0 110.922 -179.774 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.233 -0.889 . . . . 0.0 111.045 179.968 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.263 0 N-CA-C 112.508 -0.237 . . . . 0.0 112.508 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -59.58 -17.05 39.65 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.603 2.202 . . . . 0.0 112.333 -179.775 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 9.4 mt -83.09 -48.59 10.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.987 -179.813 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -84.56 58.15 5.0 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.5 -179.803 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -95.45 147.65 33.35 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 120.607 0.241 . . . . 0.0 110.9 179.953 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -69.82 8.19 0.84 Allowed 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.736 2.291 . . . . 0.0 112.528 -179.679 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.466 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.1 OUTLIER -82.84 39.94 0.66 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.174 -179.732 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.744 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 7.2 t -87.92 -33.09 18.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.484 -179.929 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.5 -36.89 76.92 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 176.948 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.0 t -68.93 -35.5 76.87 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.599 177.318 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.744 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.3 mtm -64.42 -36.05 82.9 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.972 177.506 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.727 ' HA ' ' HE2' ' A' ' 23' ' ' MET . 3.1 mp -52.15 -48.18 65.03 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.113 179.185 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.02 -33.86 76.78 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.15 178.846 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.7 m -101.5 25.53 8.3 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.715 -178.811 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.509 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -138.04 120.29 10.86 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.271 179.556 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.655 ' HG2' ' HB2' ' A' ' 19' ' ' GLU . 19.3 Cg_endo -59.55 167.82 6.04 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.61 2.207 . . . . 0.0 111.854 179.033 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.19 -40.95 83.08 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.552 2.168 . . . . 0.0 112.537 -179.66 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -73.18 -8.91 57.85 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.014 -179.778 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.655 ' HB2' ' HG2' ' A' ' 16' ' ' PRO . 1.4 tp10 -91.67 15.33 12.9 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.043 -179.637 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.619 HE21 ' HB2' ' A' ' 21' ' ' LYS . 0.2 OUTLIER -59.23 -49.27 78.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.011 0.434 . . . . 0.0 110.764 -179.723 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.619 ' HB2' HE21 ' A' ' 20' ' ' GLN . 0.3 OUTLIER -56.82 -22.46 36.63 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.159 -179.303 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.543 ' HB3' ' HG3' ' A' ' 19' ' ' GLU . 4.1 tt0 -72.96 -76.5 0.12 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.946 0.403 . . . . 0.0 111.413 179.728 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.727 ' HE2' ' HA ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -69.73 -95.76 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -176.854 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.634 HD23 HD11 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -62.14 1.64 0.29 Allowed 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -175.602 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.55 -116.49 9.09 Favored Glycine 0 N--CA 1.444 -0.816 0 N-CA-C 108.226 -1.95 . . . . 0.0 108.226 -174.376 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.583 ' HB3' ' HB2' ' A' ' 55' ' ' LEU . 1.9 mp0 -75.75 -69.18 0.51 Allowed 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 168.814 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.94 ' HG3' HD21 ' A' ' 31' ' ' LEU . 23.3 tpt180 -160.25 8.9 0.1 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.132 -1.394 . . . . 0.0 107.458 175.416 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 1.002 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -58.28 -74.82 0.06 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.398 -1.274 . . . . 0.0 113.879 -172.259 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.63 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -38.54 -47.0 3.18 Favored Pre-proline 0 CA--C 1.536 0.441 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 -175.229 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.483 ' HD2' ' O ' ' A' ' 27' ' ' ARG . 52.2 Cg_exo -57.5 -42.04 65.41 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.172 1.915 . . . . 0.0 113.398 -179.126 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.94 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -70.79 -43.26 69.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.18 0.514 . . . . 0.0 109.833 -179.067 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.679 HG21 HD12 ' A' ' 43' ' ' ILE . 0.4 OUTLIER -77.01 -15.57 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.06 177.901 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.649 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 4.9 tt0 -63.17 -35.08 79.11 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 177.101 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.26 -30.19 65.99 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.011 -0.995 . . . . 0.0 108.651 174.676 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.51 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 7.7 mtt -100.12 24.66 8.35 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.881 177.539 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.649 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -64.65 -31.46 5.68 Favored Pre-proline 0 CA--C 1.535 0.377 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.694 -178.213 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.555 ' CD ' ' N ' ' A' ' 36' ' ' HIS . 64.5 Cg_exo -38.61 -27.65 0.12 Allowed 'Trans proline' 0 C--N 1.363 1.313 0 C-N-CA 121.98 1.786 . . . . 0.0 111.9 178.244 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.858 HG22 HD12 ' A' ' 39' ' ' LEU . 13.6 m -77.66 -95.32 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 175.8 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.858 HD12 HG22 ' A' ' 38' ' ' THR . 2.2 mp -154.59 42.34 0.49 Allowed 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 177.662 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -42.19 105.99 0.05 Allowed 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 178.065 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.63 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . 170.49 -63.75 0.17 Allowed Glycine 0 N--CA 1.447 -0.576 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.883 -176.846 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.698 ' HE3' ' HG2' ' B' ' 12' ' ' GLU . 0.0 OUTLIER -77.86 -30.6 50.99 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.745 0.307 . . . . 0.0 110.658 178.773 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.776 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 60.0 mt -54.05 -62.22 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.244 -179.711 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 1.002 ' HA ' HD22 ' A' ' 28' ' ' LEU . 9.9 t -47.1 -41.14 16.69 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.185 -179.471 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.704 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -53.3 -63.71 4.83 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.854 178.769 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.755 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.63 -51.06 68.47 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.686 0.279 . . . . 0.0 111.476 -178.548 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.494 ' HB2' HD21 ' A' ' 28' ' ' LEU . 2.3 mm? -78.67 4.8 12.64 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.772 -178.044 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.688 ' HB3' ' HD2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -66.25 -11.74 52.08 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.919 0.39 . . . . 0.0 110.62 179.371 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.443 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 3.2 mm-40 -74.64 13.5 0.61 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.265 177.605 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.525 HD11 ' HE3' ' A' ' 68' ' ' LYS . 0.1 OUTLIER -84.87 156.84 3.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.008 -179.66 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.457 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 1.1 m-20 -71.36 156.36 39.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.744 -179.817 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.822 ' HA ' HD23 ' A' ' 55' ' ' LEU . 3.1 m120 -82.41 -22.8 35.21 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 121.266 0.555 . . . . 0.0 109.598 176.423 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -74.61 -37.33 62.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.325 0.583 . . . . 0.0 109.794 176.807 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.07 -22.57 58.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.304 179.348 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.822 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.4 OUTLIER -63.04 -48.17 79.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.882 178.56 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.526 ' O ' ' HG3' ' A' ' 60' ' ' GLU . 53.1 tp -55.28 -43.79 75.08 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.347 179.01 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -58.41 -41.17 84.34 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.056 179.226 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.521 ' HB3' ' HG ' ' A' ' 65' ' ' LEU . 24.4 mmt -60.12 -36.69 78.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.058 179.687 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.772 HD12 ' NE ' ' A' ' 27' ' ' ARG . 8.3 tt -70.9 -19.83 62.56 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.286 -179.19 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.526 ' HG3' ' O ' ' A' ' 56' ' ' LEU . 13.7 mt-10 -106.53 -3.72 20.52 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 -178.607 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.539 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.3 OUTLIER -122.52 83.08 47.44 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 120.602 0.239 . . . . 0.0 111.213 -179.447 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -59.94 -31.93 94.38 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.312 2.008 . . . . 0.0 111.945 179.237 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -78.09 -49.01 14.76 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.498 -179.793 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 47.4 m -70.58 -52.78 19.22 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.889 0.376 . . . . 0.0 111.439 -178.63 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.889 HD21 HD13 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -57.93 -62.24 1.95 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.26 -178.704 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.627 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.5 OUTLIER -50.71 -35.77 32.9 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.157 -177.831 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.61 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 4.2 m -67.96 -36.21 79.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.292 0.568 . . . . 0.0 110.049 178.127 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.525 ' HE3' HD11 ' A' ' 50' ' ' ILE . 9.7 ttpt -66.12 -57.67 7.15 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.11 178.556 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.621 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 42.0 t -65.21 -15.64 18.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.373 178.572 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.61 ' HB3' ' O ' ' A' ' 67' ' ' SER . 9.4 t70 -57.3 -48.98 77.55 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 176.313 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.558 ' HB3' HD13 ' B' ' 6' ' ' LEU . 4.5 tt0 -68.6 -21.97 64.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.673 176.515 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.776 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -63.95 -51.17 65.62 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.817 179.597 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.589 HG22 ' O ' ' A' ' 70' ' ' ASP . 2.6 m -56.15 -29.17 26.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 176.851 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.523 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -70.86 -32.47 69.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.055 178.64 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.717 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.6 m -57.06 -33.48 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 178.515 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.732 HD13 ' HB2' ' A' ' 39' ' ' LEU . 39.0 mt -66.56 -48.3 70.1 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 175.96 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 17.1 mm100 -54.72 -36.79 65.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.315 178.916 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.89 -20.69 38.32 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.159 178.57 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.465 ' O ' ' HB3' ' A' ' 83' ' ' GLU . 12.1 t-80 -59.08 -68.82 0.23 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.902 -179.381 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -63.55 -9.12 11.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.214 -179.755 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.55 -69.43 0.58 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.426 -179.67 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.1 -23.54 64.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.427 -178.95 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.465 ' HB3' ' O ' ' A' ' 79' ' ' HIS . 1.4 tt0 -74.66 -47.48 31.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.89 -179.577 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -79.95 -4.94 54.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.079 -179.939 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -73.7 -43.91 57.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.206 -179.879 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -82.11 -28.29 32.34 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.002 -179.683 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.13 8.36 8.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.955 -179.871 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -88.85 44.72 1.23 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.015 179.924 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -97.73 126.87 50.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.044 -179.983 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 32.5 m-20 -96.6 7.27 46.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.037 -179.97 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 99.6 p -79.15 -5.14 53.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.864 179.837 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.45 -18.52 63.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.114 -179.918 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.65 158.22 17.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.0 -179.987 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -80.8 92.45 1.44 Allowed Glycine 0 N--CA 1.451 -0.367 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.426 179.817 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.414 ' HA ' ' HD3' ' A' ' 96' ' ' PRO . 31.6 m -104.96 149.19 37.29 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 120.576 0.227 . . . . 0.0 111.159 -179.738 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 95' ' ' VAL . 22.4 Cg_exo -65.26 -160.58 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.687 2.258 . . . . 0.0 112.361 -179.841 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 75.5 p -85.16 -174.85 5.46 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.865 179.885 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 15.6 m . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.172 -0.918 . . . . 0.0 111.095 -179.947 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.907 0.384 . . . . 0.0 111.008 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 25.6 m -94.21 157.46 3.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.167 -179.975 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 9.0 mttm -93.83 94.3 8.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.013 -179.954 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . 0.523 ' HB3' ' O ' ' B' ' 7' ' ' ASN . 9.3 t -73.72 -178.12 3.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.824 179.717 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 5' ' ' ASN . . . . . 0.432 ' HB3' ' HG2' ' A' ' 71' ' ' GLU . 0.3 OUTLIER -106.05 -52.66 2.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.029 -179.809 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.558 HD13 ' HB3' ' A' ' 71' ' ' GLU . 1.4 tp -74.45 -77.85 0.11 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.014 -179.75 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . 0.654 HD22 ' H ' ' B' ' 9' ' ' ASN . 2.1 t30 -83.71 138.33 40.88 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.026 179.867 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.481 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 5.6 Cg_exo -79.86 -7.78 14.44 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.75 2.3 . . . . 0.0 111.928 179.234 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 9' ' ' ASN . . . . . 0.654 ' H ' HD22 ' B' ' 7' ' ' ASN . 64.8 m-20 -123.38 56.31 1.2 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.185 -179.76 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . 0.755 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -60.8 98.94 0.08 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.707 179.507 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.579 ' HG2' ' O ' ' B' ' 9' ' ' ASN . 0.0 OUTLIER -124.99 156.47 38.05 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.471 178.446 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . 0.698 ' HG2' ' HE3' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -56.25 166.49 0.82 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.764 0.316 . . . . 0.0 111.416 -179.656 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' B' B ' 13' ' ' PHE . . . . . 0.704 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 1.1 t80 -88.67 64.15 7.23 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.681 179.84 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.562 ' N ' ' CD ' ' B' ' 15' ' ' PRO . 1.3 t -131.53 33.31 0.24 Allowed Pre-proline 0 CA--C 1.539 0.544 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 178.322 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 15' ' ' PRO . . . . . 0.738 ' HG3' ' HB2' ' B' ' 19' ' ' TYR . 31.8 Cg_endo -58.25 -34.11 98.27 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 122.278 1.985 . . . . 0.0 113.123 179.599 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.76 -43.11 3.19 Favored Glycine 0 N--CA 1.449 -0.468 0 N-CA-C 110.864 -0.894 . . . . 0.0 110.864 -175.27 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.525 ' O ' ' HG3' ' A' ' 21' ' ' LYS . 21.4 m -116.73 -172.26 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 176.588 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.539 ' HG3' ' NE2' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -60.17 104.96 0.36 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.812 0.339 . . . . 0.0 110.849 179.385 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.738 ' HB2' ' HG3' ' B' ' 15' ' ' PRO . 0.2 OUTLIER -79.47 131.31 36.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.936 -179.86 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 86.68 10.4 73.08 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.543 -179.946 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -101.26 -17.07 16.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.839 0.352 . . . . 0.0 110.915 179.972 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 11.3 mm . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.247 -0.882 . . . . 0.0 111.108 -179.974 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.24 0 N-CA-C 112.516 -0.234 . . . . 0.0 112.516 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -63.86 101.75 0.34 Allowed 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.6 2.2 . . . . 0.0 112.282 179.947 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -93.72 26.67 3.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.932 179.904 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.77 33.25 4.25 Favored Glycine 0 N--CA 1.453 -0.22 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.42 179.946 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.66 -50.52 0.31 Allowed Pre-proline 0 C--N 1.33 -0.276 0 N-CA-C 111.521 0.193 . . . . 0.0 111.521 179.84 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_exo -67.7 82.26 0.43 Allowed 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.326 2.017 . . . . 0.0 112.341 -179.502 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.49 ' O ' ' HG3' ' A' ' 11' ' ' MET . 0.2 OUTLIER -100.02 108.32 20.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.412 179.169 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.741 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 5.8 t -87.9 -32.03 19.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.886 -178.513 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.23 -33.66 71.28 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 177.707 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -75.09 -34.98 61.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.94 177.574 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.741 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 9.0 mtm -64.42 -36.78 85.28 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.898 177.869 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.621 HD11 ' HB3' ' A' ' 24' ' ' LEU . 1.2 mp -52.59 -56.28 16.39 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.906 178.626 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.29 -25.27 66.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.881 178.202 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.6 m -101.61 23.7 10.83 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.834 -178.534 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.724 ' HB1' ' HB2' ' A' ' 19' ' ' GLU . . . -134.45 58.07 27.37 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.753 -0.203 . . . . 0.0 111.161 179.545 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.505 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 52.6 Cg_exo -53.88 -49.62 16.53 Favored 'Trans proline' 0 CA--C 1.537 0.625 0 C-N-CA 122.612 2.208 . . . . 0.0 113.626 -178.768 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.505 ' HD3' ' HB2' ' A' ' 16' ' ' PRO . 16.5 Cg_exo -68.32 -166.73 0.15 Allowed 'Trans proline' 0 C--N 1.355 0.887 0 C-N-CA 122.095 1.863 . . . . 0.0 112.198 -179.523 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -73.8 70.72 1.44 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.72 179.265 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.724 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 1.9 mm-40 -104.01 7.27 36.53 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.886 -179.47 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.644 HE22 ' HG3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -46.43 -61.0 2.0 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.223 -177.73 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.687 ' HD2' ' HA ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER -56.32 -25.02 47.44 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.293 -179.32 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.495 ' OE1' ' HG3' ' A' ' 23' ' ' MET . 2.9 tt0 -73.44 -75.56 0.14 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.844 0.354 . . . . 0.0 111.52 179.468 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.617 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.15 -96.58 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -176.309 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.621 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -61.96 0.73 0.35 Allowed 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 -175.532 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 65.0 -117.29 10.11 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 108.421 -1.872 . . . . 0.0 108.421 -174.322 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.433 ' O ' HD13 ' A' ' 24' ' ' LEU . 1.2 mp0 -75.91 -68.54 0.57 Allowed 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 169.401 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.971 ' HG2' HD22 ' A' ' 59' ' ' LEU . 1.7 tpt180 -160.06 11.75 0.12 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.216 175.537 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.485 ' O ' HG13 ' A' ' 32' ' ' ILE . 4.1 mm? -57.2 -78.45 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.608 -1.178 . . . . 0.0 113.49 -173.302 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.716 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -35.05 -48.33 1.04 Allowed Pre-proline 0 CA--C 1.539 0.521 0 N-CA-C 113.642 0.978 . . . . 0.0 113.642 -175.517 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.545 ' HG2' ' HD2' ' A' ' 27' ' ' ARG . 46.8 Cg_exo -59.69 -42.16 49.11 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 122.367 2.045 . . . . 0.0 113.736 -178.204 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.784 HD22 ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.61 -44.54 67.06 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 121.131 0.491 . . . . 0.0 109.97 -178.474 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.529 HG23 ' CG1' ' A' ' 69' ' ' VAL . 0.2 OUTLIER -76.9 -13.0 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.968 178.179 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.612 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 49.6 tp60 -62.33 -37.47 85.72 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 176.75 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.47 -32.5 71.46 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.139 174.749 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.54 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 7.0 mtt -100.13 28.75 4.68 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.203 177.85 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.612 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.2 OUTLIER -63.16 -32.15 8.1 Favored Pre-proline 0 CA--C 1.535 0.402 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -177.429 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.567 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 60.0 Cg_exo -36.65 -32.85 0.13 Allowed 'Trans proline' 0 C--N 1.362 1.275 0 C-N-CA 122.083 1.855 . . . . 0.0 112.27 179.23 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.511 HG22 HD12 ' A' ' 76' ' ' LEU . 86.6 m -78.26 -88.08 0.05 Allowed 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.8 176.836 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.681 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . 0.1 OUTLIER -171.35 61.17 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.447 178.203 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.476 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -44.99 -34.24 2.36 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.848 0.356 . . . . 0.0 111.616 179.661 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.639 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -50.94 -58.16 9.88 Favored Glycine 0 C--N 1.33 0.243 0 CA-C-N 115.989 -0.551 . . . . 0.0 113.867 -178.995 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.494 ' H ' HD12 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -77.86 -34.35 51.74 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -177.867 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.65 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 36.1 mt -55.98 -55.43 18.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.715 -0.22 . . . . 0.0 111.481 -179.008 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.566 HG21 ' CD2' ' A' ' 29' ' ' PHE . 6.1 t -47.56 -44.18 25.91 Favored 'General case' 0 CA--C 1.522 -0.119 0 CA-C-O 121.006 0.432 . . . . 0.0 110.135 178.637 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.803 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -49.65 -65.39 2.85 Favored Glycine 0 N--CA 1.448 -0.501 0 CA-C-N 115.312 -0.858 . . . . 0.0 113.464 -179.862 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.615 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.33 -50.72 68.88 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -177.276 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.5 HD22 ' N ' ' A' ' 47' ' ' LEU . 2.9 mm? -79.06 6.2 10.04 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -177.917 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.559 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.21 -7.65 19.55 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.984 0.421 . . . . 0.0 110.622 179.195 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.436 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 3.3 mt-10 -81.96 16.8 1.75 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.664 178.437 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -83.16 158.82 3.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.816 -179.514 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -70.59 160.05 33.23 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.02 0.438 . . . . 0.0 111.838 -178.089 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.943 ' HA ' HD23 ' A' ' 55' ' ' LEU . 4.9 m120 -83.67 -31.39 26.17 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.448 178.738 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.1 t -74.01 -34.27 64.1 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.387 0.613 . . . . 0.0 109.523 177.516 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.442 ' OE2' ' HE3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -75.58 -28.65 59.03 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.645 179.367 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.943 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.7 OUTLIER -59.34 -47.07 86.79 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 120.923 0.392 . . . . 0.0 110.003 179.124 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.684 ' HA ' HD21 ' A' ' 59' ' ' LEU . 2.2 tm? -56.33 -48.04 77.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.926 -179.844 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.45 ' O ' ' HB2' ' A' ' 61' ' ' SER . 15.4 t60 -58.05 -24.67 59.33 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.918 -179.119 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.631 ' HE2' ' HA ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -73.86 -58.17 3.48 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -177.542 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.971 HD22 ' HG2' ' A' ' 27' ' ' ARG . 2.2 pt? -65.59 -6.03 9.9 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.962 -179.024 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.542 ' HG3' HD13 ' A' ' 56' ' ' LEU . 13.4 mm-40 -106.68 -10.86 15.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.679 177.455 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.572 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.5 OUTLIER -122.5 97.83 44.3 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.137 179.75 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -64.06 -30.53 66.07 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.201 1.934 . . . . 0.0 112.028 179.07 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -78.22 -51.26 10.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.599 -179.7 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.444 ' HB3' ' HB3' ' A' ' 61' ' ' SER . 33.2 t -69.07 -44.65 72.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.686 -178.033 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.784 ' HG ' HD22 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -69.86 -62.14 1.5 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.986 -177.136 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.667 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -51.15 -29.28 13.13 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.962 -177.646 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.476 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.4 OUTLIER -69.59 -39.53 77.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.138 0.494 . . . . 0.0 110.233 178.013 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.442 ' HE3' ' OE2' ' A' ' 54' ' ' GLU . 5.0 mtmm -65.49 -61.05 2.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.236 178.862 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.529 ' CG1' HG23 ' A' ' 32' ' ' ILE . 53.0 t -61.78 -20.95 24.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.942 -179.416 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.603 ' O ' HG22 ' A' ' 73' ' ' VAL . 16.5 t70 -54.63 -51.76 64.39 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 176.458 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.497 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 0.5 OUTLIER -69.23 -26.3 64.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.017 177.003 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.686 ' O ' HG22 ' A' ' 75' ' ' VAL . . . -61.17 -48.2 82.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.04 179.952 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.603 HG22 ' O ' ' A' ' 70' ' ' ASP . 2.6 m -58.48 -31.58 43.66 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 177.541 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.497 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -68.16 -37.92 81.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.145 178.952 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.686 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -60.61 -31.17 48.38 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.217 0 CA-C-O 120.919 0.39 . . . . 0.0 110.225 179.511 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.681 ' HG ' ' HB3' ' A' ' 39' ' ' LEU . 2.3 tm? -71.41 -49.54 40.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.215 178.803 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 9.7 mm100 -57.62 -37.64 73.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.457 179.214 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.29 -21.78 39.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.905 -0.588 . . . . 0.0 111.067 179.293 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.504 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 11.9 t-80 -59.74 -53.13 61.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.025 -179.534 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -73.7 -7.03 50.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.088 -179.812 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.67 -54.76 5.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.49 -179.592 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 5.5 mmtp -78.6 -23.82 45.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.41 -178.975 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.504 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 1.5 tt0 -77.09 -34.98 56.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.19 -179.575 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -72.46 -27.42 62.29 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.075 -179.779 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.22 -72.05 0.17 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.061 179.928 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -87.83 133.37 33.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.918 179.934 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.87 57.21 2.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.842 179.976 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -81.39 6.5 14.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.104 179.864 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -97.89 169.66 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.962 179.844 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.82 37.36 1.3 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.951 -179.937 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.5 p -77.46 -10.13 59.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.942 -179.993 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.01 165.68 24.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.024 179.839 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -95.25 -35.21 11.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.942 179.981 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -104.66 96.13 1.21 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.547 -179.809 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 12.5 t -93.41 118.89 67.7 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 120.598 0.237 . . . . 0.0 111.032 -179.942 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -57.95 147.77 80.1 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.53 2.154 . . . . 0.0 112.139 179.913 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -81.98 153.82 26.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.904 -179.908 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.6 m . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.105 -0.95 . . . . 0.0 111.141 179.924 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 17.2 m . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.829 0.347 . . . . 0.0 110.992 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 23.8 m -90.12 -178.69 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.155 -179.89 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 2.5 pttp -85.71 146.32 26.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.953 -179.901 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . 0.445 ' HB2' ' HB2' ' B' ' 10' ' ' ALA . 7.6 t -87.32 -161.72 0.72 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.929 -179.822 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -103.57 -50.79 3.34 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.237 179.117 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.432 HD12 ' HA ' ' B' ' 6' ' ' LEU . 7.5 tp -68.87 -77.53 0.08 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.112 178.182 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . 0.495 HD22 ' H ' ' B' ' 9' ' ' ASN . 1.1 t30 -92.08 127.6 48.72 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.327 177.768 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 6.6 Cg_exo -73.77 -2.12 11.76 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.281 1.987 . . . . 0.0 112.177 -179.717 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 9' ' ' ASN . . . . . 0.495 ' H ' HD22 ' B' ' 7' ' ' ASN . 8.3 m-20 -123.76 40.31 3.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.042 -179.774 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . 0.615 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -53.1 92.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.508 -179.383 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.497 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -121.37 136.23 54.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.946 179.125 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -47.67 168.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -177.905 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 13' ' ' PHE . . . . . 0.803 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.6 OUTLIER -87.32 77.67 8.9 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.783 179.171 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.879 ' H ' ' HD2' ' B' ' 15' ' ' PRO . 3.2 m -117.36 -33.19 0.08 OUTLIER Pre-proline 0 CA--C 1.54 0.595 0 N-CA-C 114.255 1.205 . . . . 0.0 114.255 -175.897 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 15' ' ' PRO . . . . . 0.879 ' HD2' ' H ' ' B' ' 14' ' ' VAL . 10.0 Cg_endo -52.4 -35.76 66.55 Favored 'Trans proline' 0 C--N 1.356 0.946 0 C-N-CA 121.772 1.648 . . . . 0.0 112.508 -178.672 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.52 -8.54 7.07 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.5 -179.767 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.687 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 27.5 m -108.49 -175.78 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.635 0.255 . . . . 0.0 110.627 179.822 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.644 ' HG3' HE22 ' A' ' 20' ' ' GLN . 1.8 mppt? -63.95 87.88 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.012 0.434 . . . . 0.0 110.556 179.804 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.497 ' CE2' ' HG2' ' B' ' 11' ' ' LYS . 0.2 OUTLIER -81.04 108.81 15.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.101 -178.922 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 90.5 47.31 3.79 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.445 -179.929 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . 0.424 ' O ' HD13 ' B' ' 22' ' ' ILE . 36.9 t30 -95.83 -30.66 13.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.892 0.377 . . . . 0.0 111.024 -179.798 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . 0.424 HD13 ' O ' ' B' ' 21' ' ' ASN . 17.6 mm . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.191 -0.909 . . . . 0.0 110.994 179.854 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.232 0 N-CA-C 112.409 -0.276 . . . . 0.0 112.409 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -59.63 94.97 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.575 2.183 . . . . 0.0 112.269 -179.838 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.2 tt -86.35 115.59 23.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.752 179.634 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.18 104.46 1.93 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.69 -0.766 . . . . 0.0 112.512 -179.724 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 70.7 m -81.61 111.38 25.27 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 120.595 0.236 . . . . 0.0 110.868 179.934 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.579 ' HG2' ' N ' ' A' ' 10' ' ' SER . 35.3 Cg_endo -65.42 -170.36 0.16 Allowed 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.602 2.202 . . . . 0.0 112.445 -179.769 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.448 ' O ' ' HG3' ' A' ' 11' ' ' MET . 22.3 mt -91.21 -78.12 0.4 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.227 -179.447 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.761 HG21 ' HB3' ' A' ' 29' ' ' PHE . 9.9 t -87.9 -31.28 19.55 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.559 -179.157 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.509 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.18 -36.57 75.56 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 177.175 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.579 ' N ' ' HG2' ' A' ' 6' ' ' PRO . 35.2 t -71.4 -34.19 70.15 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.625 177.003 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.736 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 5.3 mtm -64.32 -34.31 77.84 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 177.347 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.633 HD11 ' HB3' ' A' ' 24' ' ' LEU . 3.4 mp -52.54 -52.61 53.97 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.902 178.481 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.09 -25.51 67.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.895 178.414 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.6 p -101.93 13.23 35.37 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.846 -178.676 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.777 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -134.33 57.85 26.29 Favored Pre-proline 0 CA--C 1.534 0.339 0 CA-C-O 120.528 0.204 . . . . 0.0 111.29 -179.871 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.514 ' HD3' ' N ' ' A' ' 15' ' ' ALA . 49.4 Cg_exo -58.47 -49.22 12.61 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 122.725 2.283 . . . . 0.0 114.181 -178.272 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.48 ' HD2' ' N ' ' A' ' 16' ' ' PRO . 37.8 Cg_endo -66.22 -158.48 0.04 OUTLIER 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 122.063 1.842 . . . . 0.0 112.746 -178.283 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -73.67 64.68 0.93 Allowed 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.873 179.921 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.777 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -104.47 9.88 35.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.676 -179.933 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -47.07 -67.27 0.29 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.521 -179.14 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.81 ' HE3' ' HA ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER -55.79 -21.21 18.12 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.814 -177.706 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.59 ' N ' ' HD3' ' A' ' 21' ' ' LYS . 10.3 tt0 -73.52 -78.32 0.1 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.006 0.431 . . . . 0.0 111.254 179.177 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.587 ' HE2' ' HB3' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -69.25 -95.99 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -176.909 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.649 ' HB2' ' HG2' ' A' ' 30' ' ' PRO . 0.3 OUTLIER -61.63 -1.32 0.56 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -175.323 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.597 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.38 -117.41 10.61 Favored Glycine 0 CA--C 1.505 -0.569 0 N-CA-C 108.262 -1.935 . . . . 0.0 108.262 -174.6 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.477 ' O ' HD22 ' A' ' 55' ' ' LEU . 0.6 OUTLIER -76.45 -67.59 0.68 Allowed 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 107.143 -1.428 . . . . 0.0 107.143 168.049 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.69 ' HB2' HD13 ' A' ' 55' ' ' LEU . 1.6 tpt180 -159.71 10.54 0.12 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 114.364 -1.289 . . . . 0.0 108.614 175.302 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.513 HD12 ' HA ' ' A' ' 44' ' ' THR . 3.8 mm? -56.91 -84.84 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.655 -1.157 . . . . 0.0 113.929 -172.924 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.761 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -31.14 -51.09 0.43 Allowed Pre-proline 0 CA--C 1.539 0.535 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -174.833 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.649 ' HG2' ' HB2' ' A' ' 24' ' ' LEU . 54.1 Cg_exo -56.43 -42.75 62.37 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 122.238 1.959 . . . . 0.0 113.875 -178.178 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.662 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.12 -44.06 66.38 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.112 0.482 . . . . 0.0 110.375 -178.232 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.73 HG21 HD12 ' A' ' 43' ' ' ILE . 0.0 OUTLIER -72.55 -20.64 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.708 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.127 179.254 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 62.8 tp60 -62.79 -31.45 72.43 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 175.684 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.33 -20.14 55.34 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 114.99 -1.004 . . . . 0.0 109.984 176.942 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.602 ' HG3' ' HA ' ' A' ' 32' ' ' ILE . 2.5 mtt -98.49 7.06 46.65 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.117 178.679 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -77.29 163.46 64.45 Favored Pre-proline 0 N--CA 1.447 -0.621 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.427 -179.75 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -100.85 90.05 0.08 OUTLIER 'Cis proline' 0 C--N 1.353 0.769 0 C-N-CA 124.535 -1.027 . . . . 0.0 113.49 4.078 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 6.5 m -98.99 -70.36 0.73 Allowed 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 176.163 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 1.035 HD23 HD12 ' A' ' 76' ' ' LEU . 2.9 tp -171.76 28.62 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.157 176.887 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -33.6 -38.96 0.05 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.046 -179.272 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.584 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -52.26 -53.0 33.3 Favored Glycine 0 C--N 1.33 0.238 0 C-N-CA 121.052 -0.594 . . . . 0.0 113.048 179.61 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.95 ' HB3' HD11 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -78.16 -34.14 49.9 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 122.676 -0.308 . . . . 0.0 111.427 -179.725 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.829 HD13 ' HA ' ' A' ' 73' ' ' VAL . 1.8 mt -54.14 -57.98 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-O 120.583 0.23 . . . . 0.0 110.789 179.979 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.513 ' HA ' HD12 ' A' ' 28' ' ' LEU . 10.0 t -47.76 -46.03 29.73 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.078 178.558 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.581 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -50.15 -66.49 2.32 Favored Glycine 0 N--CA 1.449 -0.462 0 CA-C-N 115.608 -0.724 . . . . 0.0 113.214 179.838 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.505 ' HB2' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -55.47 -51.68 66.14 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -177.648 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.486 HD12 ' HB2' ' B' ' 7' ' ' ASN . 2.8 mm? -79.35 8.33 6.33 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -177.975 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.581 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.13 -6.82 14.57 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.08 0.467 . . . . 0.0 110.334 178.676 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.471 ' OE2' ' HB3' ' B' ' 11' ' ' LYS . 3.3 mt-10 -81.66 16.06 1.91 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.607 178.698 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.84 HD11 ' NZ ' ' A' ' 68' ' ' LYS . 0.9 OUTLIER -83.18 160.25 3.58 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.633 -179.729 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.529 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 34.4 m-20 -70.99 154.98 41.36 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.97 0.414 . . . . 0.0 112.036 -178.16 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.833 ' HA ' HD23 ' A' ' 55' ' ' LEU . 1.1 t-20 -82.99 -31.08 27.72 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.034 177.995 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.2 t -73.97 -33.46 63.87 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.344 0.592 . . . . 0.0 109.477 177.592 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.529 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -75.38 -27.82 59.25 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.467 179.074 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.833 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -59.64 -47.82 84.08 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.189 179.432 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.449 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 12.2 tp -56.54 -46.27 80.76 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.623 179.361 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -59.75 -32.67 70.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.28 179.882 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.539 ' SD ' ' HE2' ' A' ' 68' ' ' LYS . 32.0 mmt -60.87 -51.61 68.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.432 -179.4 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.585 ' HG ' ' NH2' ' A' ' 27' ' ' ARG . 0.2 OUTLIER -61.61 -22.23 65.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.081 -179.057 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 56' ' ' LEU . 2.2 mt-10 -99.75 -3.64 32.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.8 179.954 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.585 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 16.0 m -122.72 80.64 48.57 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.52 179.617 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.37 -35.69 95.97 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.147 1.898 . . . . 0.0 111.996 179.85 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.579 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.67 -45.19 21.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.718 -179.466 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.579 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 7.0 m -70.47 -51.98 25.27 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.952 0.406 . . . . 0.0 111.33 -178.079 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.626 ' HG ' ' N ' ' A' ' 66' ' ' ARG . 0.3 OUTLIER -58.12 -61.06 2.83 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.672 -178.755 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.626 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 1.1 ttp180 -48.39 -33.33 8.95 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.221 -177.436 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.443 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 8.2 t -61.67 -44.23 97.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.118 0.485 . . . . 0.0 110.277 178.307 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.84 ' NZ ' HD11 ' A' ' 50' ' ' ILE . 13.6 mtpp -65.92 -63.03 1.18 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.806 179.451 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.593 ' CG1' HG23 ' A' ' 32' ' ' ILE . 55.2 t -58.77 -19.45 14.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.089 -179.496 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.59 ' O ' HG22 ' A' ' 73' ' ' VAL . 20.4 t70 -58.19 -48.89 78.91 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 175.709 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.47 ' HB3' HD13 ' B' ' 6' ' ' LEU . 3.5 tt0 -69.03 -27.23 65.48 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.817 176.603 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.598 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -60.31 -54.39 46.31 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.178 179.485 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.829 ' HA ' HD13 ' A' ' 43' ' ' ILE . 3.3 m -55.08 -29.62 22.65 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 177.932 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.432 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -73.57 -36.37 65.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.618 179.794 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.569 HG22 ' O ' ' A' ' 72' ' ' ALA . 1.1 m -56.26 -31.17 31.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 N-CA-C 109.713 -0.476 . . . . 0.0 109.713 179.493 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 1.035 HD12 HD23 ' A' ' 39' ' ' LEU . 4.4 mm? -72.21 -48.69 41.08 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.861 176.552 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 34.9 mm-40 -50.82 -34.38 27.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.316 177.906 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -82.18 -29.7 31.35 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.55 176.911 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.576 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 16.4 t-80 -61.25 -42.24 98.28 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.979 -179.913 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -71.91 -25.45 61.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.964 0.411 . . . . 0.0 110.466 178.902 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -73.64 -45.18 54.33 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.629 179.242 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.559 ' HD3' ' HG3' ' B' ' 3' ' ' LYS . 0.0 OUTLIER -76.25 -19.43 58.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.23 178.788 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.576 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 8.0 tt0 -74.22 -48.58 27.95 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.123 178.689 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.03 -46.9 87.98 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 176.479 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -85.41 59.79 5.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.364 176.911 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.52 7.78 1.71 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.575 -178.21 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.68 110.36 7.91 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.478 179.368 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.32 85.34 0.4 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.284 -178.971 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.552 HG12 ' H ' ' A' ' 91' ' ' SER . 20.9 t -93.96 115.48 32.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.967 179.632 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -89.15 4.94 46.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.944 -179.738 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.552 ' H ' HG12 ' A' ' 89' ' ' VAL . 22.8 t -81.1 -20.79 40.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.937 179.98 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -91.79 111.23 22.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.026 179.984 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -115.08 154.63 28.54 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.953 -179.902 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -88.15 -158.96 34.07 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.494 -179.958 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.583 ' H ' ' HD2' ' A' ' 96' ' ' PRO . 18.6 t -105.2 -52.73 0.1 Allowed Pre-proline 0 C--N 1.329 -0.324 0 N-CA-C 111.607 0.225 . . . . 0.0 111.607 -179.701 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.583 ' HD2' ' H ' ' A' ' 95' ' ' VAL . 71.8 Cg_endo -77.75 102.63 1.61 Allowed 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.154 1.903 . . . . 0.0 112.416 -179.853 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 60.3 p -105.56 133.18 50.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.895 179.85 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 16.5 m . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.114 -0.946 . . . . 0.0 111.029 179.848 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 27.6 m . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.752 0.311 . . . . 0.0 111.042 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 15.5 m -88.56 172.49 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.149 -179.824 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . 0.559 ' HG3' ' HD3' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -76.19 79.28 2.99 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.753 179.746 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.35 154.07 18.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.4 -179.18 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -108.67 -48.79 3.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.433 179.08 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.47 HD13 ' HB3' ' A' ' 71' ' ' GLU . 1.9 tp -64.8 -83.19 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.472 178.949 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . 0.486 ' HB2' HD12 ' A' ' 47' ' ' LEU . 0.4 OUTLIER -82.47 113.06 41.67 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.441 178.301 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -66.41 -5.05 11.84 Favored 'Trans proline' 0 N--CA 1.463 -0.296 0 C-N-CA 122.122 1.882 . . . . 0.0 112.242 -179.728 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 9' ' ' ASN . . . . . . . . . . . . . 69.0 m-20 -123.74 38.52 4.17 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.465 179.139 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . 0.505 ' HB1' ' HB2' ' A' ' 46' ' ' MET . . . -53.91 94.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.87 -178.641 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.584 ' HG2' ' CE2' ' B' ' 19' ' ' TYR . 0.0 OUTLIER -115.01 131.59 56.87 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.839 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . 0.539 ' HG2' ' HD2' ' A' ' 42' ' ' LYS . 6.7 mt-10 -50.0 178.97 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -177.204 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 13' ' ' PHE . . . . . 0.46 ' CE1' ' HG ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -86.9 79.92 8.62 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.853 179.725 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.516 ' H ' ' HD2' ' B' ' 15' ' ' PRO . 3.2 t -109.75 -49.94 0.07 OUTLIER Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 115.316 -0.857 . . . . 0.0 112.418 -177.319 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 15' ' ' PRO . . . . . 0.516 ' HD2' ' H ' ' B' ' 14' ' ' VAL . 97.5 Cg_exo -44.82 -44.07 14.62 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 122.392 2.061 . . . . 0.0 112.829 -179.058 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 81.11 -30.47 2.67 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.652 -0.785 . . . . 0.0 112.483 -179.99 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.81 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 2.1 m -94.66 -174.55 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.496 0.189 . . . . 0.0 110.619 179.495 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.428 ' HD3' ' H ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -59.28 89.4 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.075 0.464 . . . . 0.0 110.974 -178.68 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.584 ' CE2' ' HG2' ' B' ' 11' ' ' LYS . 2.1 t80 -85.63 105.7 16.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.067 -179.511 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 85.11 60.95 1.78 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.495 179.893 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . 0.442 ' ND2' ' H ' ' B' ' 21' ' ' ASN . 1.4 p30 -95.18 -8.91 34.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.727 0.299 . . . . 0.0 110.935 -179.809 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 24.1 mm . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.203 -0.903 . . . . 0.0 111.076 179.973 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.127 0 N-CA-C 112.509 -0.237 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_exo -56.56 -46.03 32.9 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.576 2.184 . . . . 0.0 112.323 -179.885 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -94.45 25.6 3.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.872 -179.961 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -81.53 -25.24 54.55 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.634 -179.868 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.98 112.65 31.68 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 120.589 0.233 . . . . 0.0 110.889 -179.947 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_exo -62.41 87.03 0.11 Allowed 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.583 2.189 . . . . 0.0 112.288 -179.908 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.45 ' O ' ' HG3' ' A' ' 11' ' ' MET . 3.3 mt -100.87 114.11 27.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.912 179.916 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.77 HG21 ' HB3' ' A' ' 29' ' ' PHE . 9.8 t -87.89 -34.15 18.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.435 -179.685 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.44 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -59.22 -36.23 75.05 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 177.068 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 5.4 t -68.98 -35.74 77.06 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.746 177.101 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.753 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 5.4 mtm -64.39 -35.92 82.46 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.943 177.769 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.813 HD11 ' HB3' ' A' ' 24' ' ' LEU . 4.2 mp -52.31 -48.48 65.37 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.07 178.921 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.97 -30.17 70.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.836 178.312 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.9 p -101.71 21.56 14.26 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.716 -179.012 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.622 ' HB1' ' CB ' ' A' ' 19' ' ' GLU . . . -134.51 59.13 34.16 Favored Pre-proline 0 CA--C 1.532 0.277 0 CA-C-O 120.555 0.217 . . . . 0.0 111.319 179.875 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.484 ' HD3' ' N ' ' A' ' 15' ' ' ALA . 52.5 Cg_exo -56.26 -49.35 15.46 Favored 'Trans proline' 0 CA--C 1.537 0.671 0 C-N-CA 122.631 2.221 . . . . 0.0 113.873 -178.706 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.479 ' HD3' ' HB2' ' A' ' 16' ' ' PRO . 23.7 Cg_exo -65.31 -162.7 0.05 OUTLIER 'Trans proline' 0 C--N 1.354 0.853 0 C-N-CA 122.272 1.981 . . . . 0.0 112.73 -178.488 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -74.48 52.8 0.51 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.216 179.508 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.622 ' CB ' ' HB1' ' A' ' 15' ' ' ALA . 2.1 mm-40 -86.6 11.09 13.6 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.727 179.97 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.596 HE22 ' HG2' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -46.04 -70.1 0.11 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.122 -179.078 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.515 ' H ' ' HG3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -55.6 -18.59 7.99 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.651 -177.668 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.541 ' HB3' ' O ' ' A' ' 19' ' ' GLU . 10.8 tp60 -73.95 -79.22 0.09 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.909 0.385 . . . . 0.0 111.457 178.223 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.698 ' SD ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.17 -94.9 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.984 -0.553 . . . . 0.0 112.412 -176.775 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.813 ' HB3' HD11 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -59.45 0.52 0.12 Allowed 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -176.588 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.556 ' N ' HD23 ' A' ' 24' ' ' LEU . . . 64.36 -118.85 13.69 Favored Glycine 0 CA--C 1.501 -0.84 0 N-CA-C 107.979 -2.048 . . . . 0.0 107.979 -174.384 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.558 ' HG2' HD22 ' A' ' 52' ' ' ASN . 29.0 mt-10 -77.26 -66.01 0.88 Allowed 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 167.659 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.825 ' HB2' HD13 ' A' ' 55' ' ' LEU . 2.5 tpt180 -160.22 9.51 0.1 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.095 -1.411 . . . . 0.0 108.472 174.76 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.94 HD12 ' HA ' ' A' ' 44' ' ' THR . 3.6 mm? -56.99 -80.42 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.732 -1.122 . . . . 0.0 113.681 -172.978 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.77 ' HB3' HG21 ' A' ' 8' ' ' THR . 0.1 OUTLIER -34.82 -48.71 1.01 Allowed Pre-proline 0 CA--C 1.538 0.505 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -174.445 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.665 ' CG ' ' HB2' ' A' ' 24' ' ' LEU . 50.5 Cg_exo -57.95 -42.85 54.1 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.15 1.9 . . . . 0.0 113.573 -178.972 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.604 HD21 ' HG3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -71.86 -47.4 53.26 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.664 -178.328 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.639 ' HA ' ' HG3' ' A' ' 35' ' ' MET . 0.0 OUTLIER -69.76 -18.22 21.91 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 C-N-CA 120.614 -0.434 . . . . 0.0 109.938 178.86 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.478 ' HB3' ' O ' ' A' ' 30' ' ' PRO . 36.4 tp60 -62.88 -34.14 76.76 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 174.136 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -74.16 -19.12 60.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 114.775 -1.102 . . . . 0.0 110.128 176.816 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.639 ' HG3' ' HA ' ' A' ' 32' ' ' ILE . 0.1 OUTLIER -98.66 -3.42 36.08 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.892 178.22 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.435 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -62.51 166.05 7.98 Favored Pre-proline 0 N--CA 1.448 -0.568 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.247 -179.951 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.405 ' HA ' ' CB ' ' A' ' 36' ' ' HIS . 69.6 Cg_endo -103.7 61.3 0.62 Allowed 'Cis proline' 0 N--CA 1.455 -0.747 0 C-N-CA 124.69 -0.962 . . . . 0.0 113.959 5.158 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 52.7 m -77.04 -73.8 0.28 Allowed 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 176.793 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.584 HD13 HD11 ' A' ' 76' ' ' LEU . 0.2 OUTLIER -171.95 49.5 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.848 176.428 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.504 ' CB ' ' HB ' ' A' ' 32' ' ' ILE . . . -41.47 -34.63 0.57 Allowed 'General case' 0 N--CA 1.462 0.13 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.582 179.907 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -54.3 -71.99 0.62 Allowed Glycine 0 N--CA 1.452 -0.28 0 CA-C-N 116.083 -0.508 . . . . 0.0 113.692 -179.207 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.541 ' O ' ' HG2' ' A' ' 46' ' ' MET . 0.0 OUTLIER -57.57 -41.85 81.91 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -177.074 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.641 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 22.7 mt -53.31 -57.4 4.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 121.079 0.466 . . . . 0.0 110.195 179.262 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.94 ' HA ' HD12 ' A' ' 28' ' ' LEU . 1.3 m -47.64 -45.78 28.19 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.247 177.475 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.744 ' HA2' ' HB2' ' B' ' 13' ' ' PHE . . . -51.25 -60.7 6.92 Favored Glycine 0 N--CA 1.445 -0.71 0 CA-C-N 115.06 -0.973 . . . . 0.0 113.231 -179.623 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.622 ' HB3' ' HB1' ' B' ' 10' ' ' ALA . 0.0 OUTLIER -54.41 -59.47 4.65 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.746 0.307 . . . . 0.0 111.779 -177.473 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.793 HD23 ' HB2' ' B' ' 7' ' ' ASN . 1.1 mp -79.9 18.23 0.84 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.162 0.431 . . . . 0.0 112.162 -176.742 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.599 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -66.01 -6.94 14.42 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.301 0.572 . . . . 0.0 109.582 175.659 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.515 ' OE1' ' HB3' ' B' ' 9' ' ' ASN . 2.6 mt-10 -93.24 25.35 3.37 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.756 179.462 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.542 HG22 ' CD ' ' A' ' 26' ' ' GLU . 3.5 tt -83.0 176.23 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.782 -179.72 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.745 ' HB2' ' HB2' ' A' ' 54' ' ' GLU . 7.0 m-20 -73.53 124.47 25.94 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.705 0.261 . . . . 0.0 111.705 179.441 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.673 ' HA ' HD23 ' A' ' 55' ' ' LEU . 3.7 t-20 -66.14 -30.54 71.05 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.448 0.642 . . . . 0.0 109.722 177.521 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.6 m -73.31 -33.19 65.03 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.838 177.612 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.745 ' HB2' ' HB2' ' A' ' 51' ' ' ASP . 3.9 mm-40 -76.96 -24.4 52.31 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.449 178.81 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.825 HD13 ' HB2' ' A' ' 27' ' ' ARG . 0.6 OUTLIER -59.08 -47.93 83.46 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 179.515 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.44 HD22 ' HA ' ' A' ' 56' ' ' LEU . 0.3 OUTLIER -59.45 -42.33 91.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.779 178.174 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.531 ' HA ' ' HG2' ' A' ' 60' ' ' GLU . 26.6 m-70 -69.27 -19.03 63.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.243 179.321 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.551 ' HG2' ' O ' ' A' ' 54' ' ' GLU . 23.8 mmt -68.66 -58.97 3.48 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.053 -179.576 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.698 HD13 ' NE ' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -61.51 -21.02 63.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.103 -179.577 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.531 ' HG2' ' HA ' ' A' ' 57' ' ' HIS . 0.6 OUTLIER -91.62 -9.57 43.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.085 179.817 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.552 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 0.5 OUTLIER -122.92 85.25 50.41 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.799 179.696 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_exo -59.88 -33.52 95.85 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.398 2.065 . . . . 0.0 112.292 -179.666 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.636 ' HG3' ' N ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -78.22 -45.8 22.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.297 -179.395 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.636 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 10.7 m -70.62 -54.16 13.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.83 0.348 . . . . 0.0 111.328 -178.695 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.632 ' HG ' ' N ' ' A' ' 66' ' ' ARG . 0.3 OUTLIER -57.82 -61.99 2.13 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.866 -178.286 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.632 ' N ' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -48.53 -35.29 12.92 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.055 -177.256 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.15 -44.01 97.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.155 0.502 . . . . 0.0 110.154 178.45 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.514 ' HZ1' HD11 ' A' ' 50' ' ' ILE . 29.4 mtpt -66.3 -62.21 1.6 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.114 179.619 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.514 ' O ' ' HB3' ' A' ' 72' ' ' ALA . 45.4 t -59.8 -21.29 21.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.187 -178.871 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.598 ' O ' HG22 ' A' ' 73' ' ' VAL . 18.5 t70 -58.34 -48.52 80.31 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 176.412 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.513 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 0.8 OUTLIER -69.04 -25.61 64.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.597 176.557 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.641 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -62.2 -53.15 59.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.015 -179.908 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.598 HG22 ' O ' ' A' ' 70' ' ' ASP . 11.1 m -57.41 -26.28 26.0 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 177.684 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.513 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -73.18 -36.84 66.64 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.187 178.618 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.564 HG13 ' HA ' ' A' ' 72' ' ' ALA . 1.0 OUTLIER -58.04 -37.65 62.71 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.147 0 CA-C-O 120.896 0.379 . . . . 0.0 110.051 179.458 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.584 HD11 HD13 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -71.8 -43.11 66.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.081 177.961 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 54.7 mm-40 -52.85 -38.51 61.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.732 178.624 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.69 -26.02 35.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.302 177.151 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.515 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 18.2 t60 -68.06 -32.17 72.33 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.039 -179.886 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -83.28 -11.25 57.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.006 -179.959 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -76.36 -63.33 1.36 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.184 -179.656 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 29.8 mttt -68.65 -14.11 62.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.14 -179.561 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.515 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 10.9 tt0 -91.12 -19.87 22.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.92 0.391 . . . . 0.0 110.807 179.6 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -68.5 -9.75 51.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.068 179.809 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.62 -43.67 96.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.962 179.949 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -83.5 -68.51 0.7 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.833 179.7 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -94.83 124.88 39.13 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.922 179.793 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -81.8 79.4 8.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.08 179.995 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -103.9 6.87 10.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.986 179.862 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -74.24 -60.47 2.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.041 -179.89 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 10.3 t -77.08 -15.03 59.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.833 -179.932 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -80.9 149.22 29.53 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.046 179.911 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -116.83 167.51 11.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.927 -179.838 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -92.99 -67.26 1.09 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.468 -179.982 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 3.2 t -84.88 125.43 70.81 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 120.586 0.231 . . . . 0.0 110.981 179.949 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -65.39 -60.18 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.476 2.118 . . . . 0.0 112.268 -179.92 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 81.7 p -90.33 154.66 19.53 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.9 -179.852 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.149 -0.929 . . . . 0.0 111.042 179.879 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 2.0 t . . . . . 0 N--CA 1.487 1.392 0 CA-C-O 120.833 0.349 . . . . 0.0 110.969 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.5 p -89.12 142.63 12.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.021 -179.764 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.64 143.64 26.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.911 179.997 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 18.0 t -78.13 -176.09 4.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.717 179.73 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -103.9 -55.91 2.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.896 -179.742 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.452 HD11 ' HG2' ' A' ' 68' ' ' LYS . 0.4 OUTLIER -62.7 -80.89 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.622 179.532 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . 0.793 ' HB2' HD23 ' A' ' 47' ' ' LEU . 1.0 OUTLIER -87.02 117.43 68.62 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.831 179.193 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -73.77 6.37 2.89 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.314 2.01 . . . . 0.0 111.957 179.619 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 9' ' ' ASN . . . . . 0.515 ' HB3' ' OE1' ' A' ' 49' ' ' GLU . 71.5 m-20 -123.08 38.73 4.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.83 179.92 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . 0.622 ' HB1' ' HB3' ' A' ' 46' ' ' MET . . . -59.37 88.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.961 -179.189 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.471 ' HG3' ' CD ' ' A' ' 49' ' ' GLU . 12.8 mttp -112.73 123.36 50.12 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 177.553 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -47.19 171.11 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -176.668 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 13' ' ' PHE . . . . . 0.744 ' HB2' ' HA2' ' A' ' 45' ' ' GLY . 0.2 OUTLIER -86.99 93.57 9.39 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.714 179.529 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.854 ' H ' ' HD2' ' B' ' 15' ' ' PRO . 17.1 t -124.3 -54.66 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.366 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -176.955 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 15' ' ' PRO . . . . . 0.854 ' HD2' ' H ' ' B' ' 14' ' ' VAL . 9.3 Cg_endo -51.68 -34.33 53.05 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 122.415 2.077 . . . . 0.0 112.597 -178.609 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . 0.484 ' O ' ' HB2' ' A' ' 21' ' ' LYS . . . 78.46 -18.55 5.48 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.314 -179.446 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.408 ' HA ' ' CD ' ' A' ' 21' ' ' LYS . 20.9 m -96.99 -171.12 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.514 0.197 . . . . 0.0 110.629 179.417 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.596 ' HG2' HE22 ' A' ' 20' ' ' GLN . 33.2 mttt -59.67 96.55 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.9 0.381 . . . . 0.0 110.571 -179.806 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.458 ' CE1' ' HG3' ' B' ' 15' ' ' PRO . 0.1 OUTLIER -85.31 98.09 10.33 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.047 -179.166 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 79.62 100.68 0.27 Allowed Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.436 -179.928 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 22.9 t30 -88.96 -16.95 30.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.767 0.318 . . . . 0.0 110.972 179.981 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.248 0.995 0 CA-C-O 118.262 -0.875 . . . . 0.0 111.05 179.985 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.201 0 CA-C-O 120.079 -0.289 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -76.24 152.38 96.19 Favored 'Cis proline' 0 C--N 1.348 0.525 0 C-N-CA 123.462 -1.474 . . . . 0.0 112.361 0.183 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.72 10.63 10.82 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.905 179.945 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -79.19 -15.29 80.57 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.571 179.966 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.644 ' HB2' ' HD3' ' A' ' 6' ' ' PRO . 23.5 m -95.24 -51.45 0.24 Allowed Pre-proline 0 CA--C 1.533 0.301 0 N-CA-C 111.469 0.174 . . . . 0.0 111.469 -179.757 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.644 ' HD3' ' HB2' ' A' ' 5' ' ' SER . 37.9 Cg_exo -60.77 91.76 0.09 OUTLIER 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 122.24 1.96 . . . . 0.0 112.358 -179.737 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.494 ' HB2' HE22 ' A' ' 33' ' ' GLN . 0.7 OUTLIER -100.98 -100.47 0.25 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.069 -179.951 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.798 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 11.7 t -88.09 -30.32 19.96 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.339 -179.776 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.68 -36.4 74.13 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 177.107 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.2 -36.26 71.84 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.785 177.341 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.798 ' HG3' ' HA ' ' A' ' 8' ' ' THR . 7.4 mtm -64.45 -38.51 91.28 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.383 178.527 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.587 ' HA ' ' HE2' ' A' ' 23' ' ' MET . 50.9 mt -52.45 -49.39 64.71 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.16 179.516 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.41 -32.38 73.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.184 178.233 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.78 27.72 6.23 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.81 -178.502 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.745 ' HB1' ' HB3' ' A' ' 19' ' ' GLU . . . -138.17 115.23 9.24 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.695 -0.229 . . . . 0.0 111.202 179.696 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_exo -55.82 168.03 1.95 Allowed 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.356 2.037 . . . . 0.0 111.589 178.845 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.606 ' O ' ' HG3' ' A' ' 20' ' ' GLN . 52.0 Cg_exo -53.96 -40.74 79.77 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.258 1.972 . . . . 0.0 112.252 -179.728 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -74.21 4.99 4.87 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.76 -179.546 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.745 ' HB3' ' HB1' ' A' ' 15' ' ' ALA . 2.7 tp10 -102.04 14.06 33.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.611 0.243 . . . . 0.0 111.346 -179.208 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.606 ' HG3' ' O ' ' A' ' 17' ' ' PRO . 0.0 OUTLIER -54.41 -56.95 13.45 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.494 -178.86 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.602 ' HB3' ' HA ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -55.94 -20.38 15.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.642 -177.963 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.451 HE21 ' HG3' ' A' ' 23' ' ' MET . 4.9 tt0 -73.0 -79.04 0.08 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.956 0.408 . . . . 0.0 111.453 179.533 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.601 ' SD ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -69.93 -94.32 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -176.684 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.601 ' HG ' ' SD ' ' A' ' 23' ' ' MET . 0.4 OUTLIER -61.46 3.34 0.13 Allowed 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 -174.705 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.74 -117.78 11.18 Favored Glycine 0 N--CA 1.444 -0.778 0 N-CA-C 108.214 -1.954 . . . . 0.0 108.214 -174.475 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 51' ' ' ASP . 1.3 mp0 -76.07 -67.55 0.67 Allowed 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 168.987 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.715 ' NE ' HD22 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -160.5 8.97 0.09 Allowed 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 114.258 -1.337 . . . . 0.0 108.086 176.466 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.904 HD22 ' HA ' ' A' ' 44' ' ' THR . 0.3 OUTLIER -59.66 -73.85 0.08 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.316 -1.311 . . . . 0.0 114.051 -173.889 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.579 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -35.27 -48.45 1.15 Allowed Pre-proline 0 CA--C 1.541 0.596 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -175.42 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.599 ' HB2' ' NH1' ' A' ' 27' ' ' ARG . 45.1 Cg_exo -59.65 -41.96 51.24 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.372 2.048 . . . . 0.0 113.387 -178.601 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.946 HD13 HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -70.33 -47.29 61.73 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 120.478 -0.489 . . . . 0.0 109.87 -178.957 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.488 HG13 ' O ' ' A' ' 28' ' ' LEU . 0.3 OUTLIER -73.3 -13.69 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.652 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.096 178.505 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.623 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 4.3 tp60 -61.33 -41.7 97.46 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 177.531 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.25 -28.8 67.53 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.124 175.13 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . 0.558 ' C ' ' HD2' ' A' ' 37' ' ' PRO . 5.5 mtt -102.01 27.42 6.6 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.345 178.393 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.623 ' HB3' ' O ' ' A' ' 33' ' ' GLN . 0.1 OUTLIER -63.79 -31.59 6.62 Favored Pre-proline 0 CA--C 1.537 0.468 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -177.083 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.601 ' HD2' ' N ' ' A' ' 36' ' ' HIS . 54.9 Cg_exo -34.63 -34.32 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.255 0 C-N-CA 122.25 1.967 . . . . 0.0 112.406 179.33 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.608 HG22 HD12 ' A' ' 76' ' ' LEU . 23.5 m -78.6 -88.08 0.06 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.79 176.638 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.436 ' CB ' ' HG ' ' A' ' 76' ' ' LEU . 0.1 OUTLIER -171.34 62.47 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.408 178.14 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.478 ' HB2' ' O ' ' A' ' 32' ' ' ILE . . . -43.81 -41.14 4.84 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.653 179.586 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.579 ' HA2' ' CZ ' ' A' ' 29' ' ' PHE . . . -50.87 -53.61 25.68 Favored Glycine 0 C--N 1.33 0.22 0 CA-C-N 116.02 -0.536 . . . . 0.0 113.807 -178.692 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.508 ' HE2' ' SD ' ' A' ' 46' ' ' MET . 0.4 OUTLIER -77.43 -39.09 48.08 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.826 0.313 . . . . 0.0 111.764 -177.969 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.621 ' CG2' ' HB1' ' A' ' 72' ' ' ALA . 31.2 mt -53.86 -56.97 6.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.5 0.19 . . . . 0.0 110.972 -179.19 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.904 ' HA ' HD22 ' A' ' 28' ' ' LEU . 10.0 t -50.76 -42.26 57.54 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.811 0.339 . . . . 0.0 110.418 178.808 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.657 ' O ' ' HB2' ' A' ' 48' ' ' LEU . . . -50.62 -67.93 1.69 Allowed Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 115.953 -0.567 . . . . 0.0 112.981 -179.761 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.508 ' SD ' ' HE2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -55.29 -46.37 76.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.789 0.295 . . . . 0.0 111.664 -178.723 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.418 HD22 ' N ' ' A' ' 47' ' ' LEU . 3.2 mm? -80.18 6.52 11.52 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 111.537 0.199 . . . . 0.0 111.537 -179.166 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.657 ' HB2' ' O ' ' A' ' 45' ' ' GLY . 0.1 OUTLIER -65.81 -10.74 40.46 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.064 0.459 . . . . 0.0 110.372 179.558 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.494 ' OE2' ' HG3' ' B' ' 11' ' ' LYS . 2.5 mm-40 -79.23 18.43 0.68 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.415 177.831 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.629 HD11 ' HE3' ' A' ' 68' ' ' LYS . 1.3 tt -83.3 160.75 3.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.175 -179.381 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.471 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 17.7 m-20 -71.15 160.29 33.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.938 -178.837 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.734 ' HA ' HD23 ' A' ' 55' ' ' LEU . 5.8 m120 -87.69 -29.61 20.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.995 177.349 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 67.9 m -72.72 -33.05 66.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.897 178.12 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.467 ' HG3' ' HB2' ' A' ' 51' ' ' ASP . 14.8 mt-10 -75.83 -28.05 58.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.612 179.041 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.734 HD23 ' HA ' ' A' ' 52' ' ' ASN . 0.4 OUTLIER -59.64 -48.81 80.18 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.303 179.597 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.481 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 1.1 tm? -61.43 -37.0 81.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.409 179.322 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.518 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 4.8 m-70 -64.52 -35.98 82.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.259 178.428 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.586 ' HB3' ' HG ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -66.01 -41.94 90.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.411 178.702 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.715 HD22 ' NE ' ' A' ' 27' ' ' ARG . 3.4 tp -69.69 -14.67 62.92 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.884 179.475 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.518 ' HG2' ' O ' ' A' ' 57' ' ' HIS . 5.0 pt-20 -106.77 -3.26 20.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.818 179.282 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.572 ' O ' ' HB3' ' A' ' 65' ' ' LEU . 4.6 m -124.39 84.74 56.29 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.968 -179.548 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -60.35 -35.03 92.8 Favored 'Trans proline' 0 N--CA 1.464 -0.255 0 C-N-CA 122.214 1.943 . . . . 0.0 112.094 179.517 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.46 ' O ' ' HB2' ' A' ' 67' ' ' SER . 0.0 OUTLIER -78.81 -44.89 22.11 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.768 -179.419 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.551 ' HB2' ' HB3' ' A' ' 61' ' ' SER . 12.8 m -74.22 -50.44 19.11 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.827 0.346 . . . . 0.0 111.539 -177.996 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.946 HD21 HD13 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -58.16 -64.96 0.73 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.118 -179.027 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.683 ' N ' HD13 ' A' ' 65' ' ' LEU . 0.6 OUTLIER -49.19 -33.87 13.38 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.793 0.33 . . . . 0.0 110.793 -178.801 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.595 ' O ' ' HB3' ' A' ' 70' ' ' ASP . 0.6 OUTLIER -69.58 -37.03 76.8 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 121.057 0.456 . . . . 0.0 110.148 177.933 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.629 ' HE3' HD11 ' A' ' 50' ' ' ILE . 9.4 ttpt -65.76 -57.86 7.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.081 178.491 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.532 HG21 ' CD1' ' A' ' 31' ' ' LEU . 46.9 t -63.48 -19.28 23.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.781 178.925 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.667 ' O ' HG22 ' A' ' 73' ' ' VAL . 9.1 t70 -55.89 -49.59 72.99 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 176.708 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.474 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 0.7 OUTLIER -69.02 -25.74 64.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.768 176.731 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.621 ' HB1' ' CG2' ' A' ' 43' ' ' ILE . . . -62.15 -44.25 97.03 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.937 179.758 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.667 HG22 ' O ' ' A' ' 70' ' ' ASP . 2.5 m -61.06 -31.71 50.71 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 177.419 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.474 ' HB3' ' O ' ' A' ' 71' ' ' GLU . . . -66.1 -38.5 88.38 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.039 178.946 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.587 HG22 ' O ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -58.72 -31.97 45.55 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.095 0 CA-C-O 121.001 0.429 . . . . 0.0 110.124 179.262 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.608 HD12 HG22 ' A' ' 38' ' ' THR . 2.4 tm? -70.97 -46.77 61.77 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.943 178.177 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -52.86 -37.05 59.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.405 179.212 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.21 -22.61 38.69 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.844 178.819 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.544 ' O ' ' HB2' ' A' ' 83' ' ' GLU . 20.4 t-80 -65.37 -36.77 84.99 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.714 179.598 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -82.84 0.68 42.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.149 -179.662 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -72.84 -70.88 0.33 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.155 -179.866 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.504 ' HD2' HG11 ' B' ' 1' ' ' VAL . 0.1 OUTLIER -72.5 -17.33 61.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.991 -179.842 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.544 ' HB2' ' O ' ' A' ' 79' ' ' HIS . 0.0 OUTLIER -86.99 -2.85 58.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.98 -179.981 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -73.87 16.0 0.25 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.729 178.693 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.466 ' H ' ' C ' ' A' ' 83' ' ' GLU . . . -63.3 114.28 3.72 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.955 -179.782 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.28 -167.37 0.41 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.896 -179.786 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.15 -172.67 1.44 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.83 -179.812 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -74.61 81.75 2.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.065 -179.897 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -100.59 15.85 4.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.892 179.883 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -86.7 14.71 6.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.912 -179.948 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.465 ' HB3' ' H ' ' A' ' 92' ' ' ALA . 3.5 m -77.93 -158.43 0.12 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.72 179.828 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.465 ' H ' ' HB3' ' A' ' 91' ' ' SER . . . -83.92 60.56 5.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.988 179.981 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 66.2 p -115.48 173.65 6.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.867 179.928 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -85.02 68.18 3.54 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.473 179.858 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 3.8 p -95.51 128.15 39.22 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 120.647 0.261 . . . . 0.0 110.99 179.977 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -72.35 95.73 0.78 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.457 2.105 . . . . 0.0 112.282 -179.879 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.2 p -91.66 39.21 1.0 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.918 179.999 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.1 t . . . . . 0 C--O 1.249 1.027 0 CA-C-O 117.967 -1.016 . . . . 0.0 111.073 179.98 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . 0.504 HG11 ' HD2' ' A' ' 82' ' ' LYS . 0.3 OUTLIER . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 120.894 0.378 . . . . 0.0 110.94 . . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -94.64 91.15 2.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.889 179.87 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.87 81.73 4.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.937 -179.815 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . 0.401 ' HB2' ' HB2' ' B' ' 10' ' ' ALA . 45.3 t -86.61 160.99 18.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.743 179.869 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -104.28 -46.71 4.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.886 179.894 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 5.7 mt -69.66 -78.59 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.683 179.706 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . 0.629 HD22 ' H ' ' B' ' 9' ' ' ASN . 1.0 OUTLIER -82.1 127.95 69.82 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.951 179.494 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.483 ' HD3' ' HA ' ' B' ' 7' ' ' ASN . 2.9 Cg_exo -76.96 -6.06 16.4 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.525 2.15 . . . . 0.0 111.948 179.249 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 9' ' ' ASN . . . . . 0.629 ' H ' HD22 ' B' ' 7' ' ' ASN . 14.6 m120 -123.12 56.65 1.16 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.945 179.963 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . 0.401 ' HB2' ' HB2' ' B' ' 4' ' ' SER . . . -60.26 96.73 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.567 179.955 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.494 ' HG3' ' OE2' ' A' ' 49' ' ' GLU . 0.7 OUTLIER -122.21 131.21 53.82 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.499 178.785 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -49.31 171.83 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.068 0.461 . . . . 0.0 112.087 -178.787 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 13' ' ' PHE . . . . . 0.465 ' CE1' ' HG ' ' A' ' 48' ' ' LEU . 0.3 OUTLIER -87.34 90.18 8.27 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.03 179.498 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.88 HG23 ' HD3' ' B' ' 15' ' ' PRO . 0.5 OUTLIER -130.33 -37.51 0.03 OUTLIER Pre-proline 0 C--N 1.323 -0.583 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 -176.669 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' B' B ' 15' ' ' PRO . . . . . 0.88 ' HD3' HG23 ' B' ' 14' ' ' VAL . 83.6 Cg_exo -46.8 -38.19 22.53 Favored 'Trans proline' 0 C--N 1.357 1.023 0 C-N-CA 121.818 1.679 . . . . 0.0 112.711 -179.004 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . 0.481 ' O ' ' HD2' ' A' ' 21' ' ' LYS . . . 80.64 -25.23 3.44 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.498 -179.906 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -98.32 -176.65 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.611 0.243 . . . . 0.0 110.846 179.636 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.602 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -60.52 90.63 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.944 0.402 . . . . 0.0 110.815 -179.888 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.48 ' CG ' ' HG2' ' B' ' 15' ' ' PRO . 0.5 OUTLIER -84.05 120.3 25.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.893 -179.743 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 87.73 38.33 7.58 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.364 -179.56 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 21.8 p30 -84.63 175.2 9.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.766 0.317 . . . . 0.0 110.885 -179.918 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.195 -0.907 . . . . 0.0 111.065 179.771 . . . . . . . . 1 1 . 1 stop_ save_