data_2h3j_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 2h3j _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 35.3 t . . . . . 0 N--CA 1.454 -0.27 0 CA-C-O 121.203 0.525 . . . . 0.0 109.87 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.47 ' O ' HG12 ' A' ' 40' ' ' VAL . 54.0 mtt180 -145.72 159.65 42.86 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.425 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.408 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 69.4 m -120.82 133.92 55.3 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.717 173.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.532 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 56.6 m-85 -114.35 129.21 56.64 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.666 -177.52 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.554 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 85.0 mtt180 -92.38 157.9 16.36 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.0 0.429 . . . . 0.0 110.692 178.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 51.8 mt -95.74 104.79 16.23 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 173.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.551 ' HB ' HG21 ' A' ' 72' ' ' VAL . 2.9 t -81.94 -14.61 55.86 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.128 0.49 . . . . 0.0 110.444 -175.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.722 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 157.93 -163.68 32.86 Favored Glycine 0 N--CA 1.442 -0.956 0 C-N-CA 120.886 -0.674 . . . . 0.0 112.038 179.308 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -97.71 153.38 18.28 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.427 ' O ' HG21 ' A' ' 19' ' ' ILE . 88.7 p -74.38 162.17 74.95 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.869 -179.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_exo -71.39 -12.64 29.88 Favored 'Trans proline' 0 CA--C 1.529 0.229 0 C-N-CA 122.58 2.186 . . . . 0.0 112.095 174.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -89.12 -0.99 57.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.742 -178.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.445 HD12 ' CA ' ' A' ' 24' ' ' ARG . 18.6 tt -65.6 124.92 21.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.984 0.421 . . . . 0.0 110.017 179.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.5 m -138.77 159.35 42.34 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.848 -0.341 . . . . 0.0 111.876 -172.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 64.1 t30 60.46 41.19 16.22 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 115.549 -0.75 . . . . 0.0 112.687 168.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 70.19 21.97 77.28 Favored Glycine 0 C--N 1.331 0.261 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.988 174.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.5 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -65.88 -23.18 66.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.729 0.265 . . . . 0.0 111.294 179.823 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.445 ' CA ' HD12 ' A' ' 19' ' ' ILE . 6.0 ttm-85 -59.61 -36.3 76.05 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 121.342 0.592 . . . . 0.0 109.507 176.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -69.24 -36.42 77.16 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.781 179.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 25.2 tpp180 -67.01 -42.22 85.33 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 176.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' A' ' 23' ' ' TYR . 84.1 mt -66.15 -43.13 87.87 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.232 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -61.55 -41.36 97.24 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.175 0.512 . . . . 0.0 110.242 178.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 63.3 m -60.47 -35.69 76.5 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.801 175.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 71.4 mtm -84.29 -11.52 56.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.613 -178.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 93.55 27.72 12.56 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.911 -0.662 . . . . 0.0 112.662 177.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.592 HD11 HD11 ' A' ' 69' ' ' LEU . 94.5 mt -105.74 102.77 12.2 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.083 0.468 . . . . 0.0 110.573 178.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.438 HD22 ' N ' ' A' ' 33' ' ' LEU . 1.8 pt? -138.02 157.11 73.63 Favored Pre-proline 0 N--CA 1.448 -0.574 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.225 -179.35 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.722 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 28.6 Cg_exo -62.13 136.8 62.6 Favored 'Trans proline' 0 C--O 1.233 0.275 0 C-N-CA 122.573 2.182 . . . . 0.0 111.92 178.05 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 114.69 -17.74 17.85 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.323 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -86.03 175.99 8.27 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-O 121.046 0.451 . . . . 0.0 110.215 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.554 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -148.56 148.18 29.88 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.045 -177.151 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 49.0 mt -122.7 130.24 52.72 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.084 178.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 14.5 ttm180 -98.13 119.6 37.07 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.41 178.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.47 HG12 ' O ' ' A' ' 8' ' ' ARG . 13.4 p -61.3 127.3 20.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -171.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.443 ' O ' ' HB3' ' A' ' 42' ' ' ARG . 76.1 t -98.0 -54.66 6.75 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 165.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.443 ' HB3' ' O ' ' A' ' 41' ' ' VAL . 15.9 ptt180 173.3 156.14 0.11 Allowed 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.359 0.6 . . . . 0.0 111.944 174.67 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 84.4 mt -118.15 142.27 33.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 170.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.619 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -74.81 134.04 75.67 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-O 120.501 0.191 . . . . 0.0 110.556 176.806 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -66.8 -19.86 52.66 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 123.233 2.622 . . . . 0.0 112.999 -174.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -51.48 -44.85 62.58 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.567 0.699 . . . . 0.0 110.509 176.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -174.97 -74.16 0.05 OUTLIER Glycine 0 N--CA 1.431 -1.651 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.328 -177.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.513 ' OD1' ' HD3' ' A' ' 63' ' ' ARG . 6.8 p-10 -177.97 127.16 0.28 Allowed Pre-proline 0 N--CA 1.442 -0.858 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 -179.088 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.619 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 73.5 Cg_endo -114.28 -168.2 0.02 OUTLIER 'Trans proline' 0 N--CA 1.43 -2.236 0 C-N-CA 124.482 3.455 . . . . 0.0 106.569 129.295 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.738 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 58.6 mt -145.1 99.9 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.35 0 C-N-CA 119.93 -0.708 . . . . 0.0 109.432 170.781 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -86.41 121.45 28.98 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 174.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.45 HG12 ' HA ' ' A' ' 40' ' ' VAL . 9.5 m -142.22 172.76 8.48 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.927 -179.047 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -122.22 150.82 41.75 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 177.078 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 29.3 p -120.11 -30.46 4.66 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -173.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 27.2 tpt180 178.61 -54.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.864 -175.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -143.82 4.79 1.32 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.568 -179.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.9 t -149.93 138.73 20.91 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.234 0.54 . . . . 0.0 111.063 -175.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.1 p -80.22 148.78 30.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.402 -178.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.573 HD11 ' N ' ' A' ' 60' ' ' ALA . 2.4 tm? -129.56 148.73 51.49 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.22 -0.445 . . . . 0.0 109.906 -178.366 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.738 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -139.72 148.11 41.85 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.969 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.593 HD12 HD13 ' A' ' 50' ' ' ILE . 3.9 pp -162.98 -179.18 6.56 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.543 -0.539 . . . . 0.0 109.543 -179.066 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 26.0 mmm-85 -110.83 170.06 8.35 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 122.03 0.919 . . . . 0.0 112.286 -177.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.513 ' HD3' ' OD1' ' A' ' 48' ' ' ASP . 18.1 ptt-85 -62.98 -35.17 79.28 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 113.771 -1.559 . . . . 0.0 111.455 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -71.52 -33.95 69.64 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.015 -178.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -75.31 -36.73 61.07 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.389 0.614 . . . . 0.0 109.536 176.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.615 HD12 HD13 ' A' ' 71' ' ' LEU . 37.6 tp -64.38 -30.39 71.43 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.737 175.028 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.09 -9.77 48.76 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.591 -178.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.455 ' HB3' HD13 ' A' ' 27' ' ' LEU . 63.6 mt -91.79 -5.38 53.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.041 0.448 . . . . 0.0 110.568 175.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.592 HD11 HD11 ' A' ' 32' ' ' LEU . 95.8 mt -119.83 153.75 35.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.952 -178.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 15.8 m -113.3 121.22 43.76 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.02 -0.537 . . . . 0.0 109.577 170.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.615 HD13 HD12 ' A' ' 66' ' ' LEU . 64.8 mt -103.46 146.37 28.62 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.263 0.554 . . . . 0.0 111.578 -175.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.551 HG21 ' HB ' ' A' ' 13' ' ' THR . 12.3 m -129.49 117.86 18.82 Favored Pre-proline 0 C--N 1.322 -0.63 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.669 173.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.532 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 7.9 Cg_exo -70.95 163.02 40.67 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 121.995 1.796 . . . . 0.0 111.728 -178.416 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 9' ' ' SER . 86.7 mt -58.33 -47.95 82.1 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 172.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 . . . . . 0 C--O 1.25 1.116 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.72 174.685 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.515 ' HB3' ' HD3' ' A' ' 8' ' ' ARG . 22.9 t . . . . . 0 N--CA 1.452 -0.347 0 CA-C-O 121.006 0.431 . . . . 0.0 110.183 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.515 ' HD3' ' HB3' ' A' ' 7' ' ' SER . 0.0 OUTLIER -143.82 157.09 44.61 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.282 -179.864 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.425 ' HB2' ' CD1' ' A' ' 74' ' ' LEU . 15.3 m -105.1 164.13 12.04 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 176.021 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -127.87 132.84 49.33 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.865 -0.334 . . . . 0.0 110.989 -176.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.465 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 17.1 mtp180 -91.1 152.23 20.7 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.18 -0.464 . . . . 0.0 109.771 175.093 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.532 HG12 ' CD2' ' A' ' 71' ' ' LEU . 33.5 mt -102.9 117.62 48.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 176.495 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 2.9 p -87.34 -24.47 24.26 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.11 0.481 . . . . 0.0 110.74 177.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 165.62 -154.19 24.71 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.822 -0.704 . . . . 0.0 111.752 -179.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.45 ' CE1' ' HG3' ' A' ' 24' ' ' ARG . 44.9 m-85 -113.82 152.97 29.9 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 -177.016 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.406 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 20.9 m -70.35 140.21 87.47 Favored Pre-proline 0 C--N 1.319 -0.741 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.395 177.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 34.8 Cg_exo -61.57 -20.51 69.02 Favored 'Trans proline' 0 CA--C 1.529 0.265 0 C-N-CA 122.874 2.382 . . . . 0.0 112.22 179.524 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.68 29.24 2.37 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.933 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.493 HG13 HD23 ' A' ' 68' ' ' LEU . 19.8 tt -74.58 149.72 7.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.534 179.003 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.501 ' O ' ' HB2' ' A' ' 23' ' ' TYR . 9.3 m -89.43 117.94 28.72 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -173.153 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 24.47 88.15 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 115.407 1.632 . . . . 0.0 115.407 165.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.66 9.13 55.05 Favored Glycine 0 CA--C 1.517 0.176 0 N-CA-C 114.797 0.679 . . . . 0.0 114.797 171.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.501 ' HB2' ' O ' ' A' ' 20' ' ' SER . 0.9 OUTLIER -64.97 -23.06 67.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 117.75 0.775 . . . . 0.0 111.37 179.785 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.45 ' HG3' ' CE1' ' A' ' 15' ' ' TYR . 34.2 ttm180 -56.02 -46.58 78.75 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 121.165 0.507 . . . . 0.0 110.0 174.083 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -65.04 -34.48 78.54 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.996 -178.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 33.9 ttm180 -73.16 -39.85 65.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.157 178.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 23' ' ' TYR . 95.3 mt -68.68 -43.57 75.84 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.26 -178.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -60.89 -42.44 97.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.248 179.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 69.9 m -67.4 -31.05 71.01 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.22 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' MET . . . . . 0.413 ' CE ' HD23 ' A' ' 27' ' ' LEU . 68.0 mtm -79.16 -27.67 42.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.233 179.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 124.48 4.51 7.52 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.32 -0.943 . . . . 0.0 112.857 177.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.533 HD11 HD13 ' A' ' 69' ' ' LEU . 92.1 mt -97.15 93.73 6.73 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 pp -139.05 159.05 68.38 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.615 -173.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.25 121.56 10.12 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.787 2.325 . . . . 0.0 112.08 177.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 114.74 -19.92 15.58 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 121.055 -0.593 . . . . 0.0 111.797 -176.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.505 ' O ' HG13 ' A' ' 12' ' ' ILE . . . -83.81 106.9 15.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.227 0.537 . . . . 0.0 110.46 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.465 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -88.58 116.33 26.75 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.772 177.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.47 HD11 HG21 ' A' ' 52' ' ' VAL . 70.5 mt -94.59 134.15 37.45 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.311 0.577 . . . . 0.0 110.236 -177.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 49.5 ttt180 -98.25 115.1 27.67 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.728 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.518 ' HA ' HG12 ' A' ' 52' ' ' VAL . 99.4 t -64.03 120.43 10.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 123.402 0.439 . . . . 0.0 111.275 -178.519 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.672 HG12 ' HG3' ' A' ' 42' ' ' ARG . 53.1 t -98.14 -53.56 7.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.52 174.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.672 ' HG3' HG12 ' A' ' 41' ' ' VAL . 25.7 mtp180 -148.46 140.12 23.66 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -173.279 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.2 mp -120.14 141.11 41.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 168.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.757 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -79.39 134.5 58.45 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-O 120.566 0.222 . . . . 0.0 110.868 176.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -64.64 -7.56 14.95 Favored 'Trans proline' 0 N--CA 1.479 0.636 0 C-N-CA 123.384 2.723 . . . . 0.0 113.159 -177.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.15 -37.93 81.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.593 0.711 . . . . 0.0 110.891 175.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.446 ' O ' ' HB2' ' A' ' 48' ' ' ASP . . . 174.3 -76.42 0.08 OUTLIER Glycine 0 N--CA 1.436 -1.332 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 -175.517 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.446 ' HB2' ' O ' ' A' ' 47' ' ' GLY . 17.2 t70 -179.58 118.37 0.22 Allowed Pre-proline 0 N--CA 1.453 -0.306 0 N-CA-C 113.658 0.985 . . . . 0.0 113.658 173.131 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.757 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 30.7 Cg_endo -111.49 160.77 0.05 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.441 1 C-N-CA 126.049 4.499 . . . . 0.0 108.835 139.309 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.646 HG21 HG11 ' A' ' 52' ' ' VAL . 2.7 mp -119.64 106.09 18.51 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.69 0 C-N-CA 118.89 -1.124 . . . . 0.0 110.028 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.54 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 0.8 OUTLIER -86.5 111.8 20.92 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 174.436 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.646 HG11 HG21 ' A' ' 50' ' ' ILE . 21.4 m -124.01 173.15 10.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.305 0.574 . . . . 0.0 111.922 -174.181 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -120.02 128.27 53.38 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.912 179.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.5 m -86.16 -40.01 16.08 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 173.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 26.2 ttp85 -179.63 -49.88 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.781 -1.099 . . . . 0.0 108.537 173.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -128.63 -24.22 3.04 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.095 174.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.8 t -93.12 138.95 31.08 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 121.131 0.491 . . . . 0.0 109.679 177.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 21.7 m -109.35 137.18 47.6 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.672 178.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.54 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 12.1 mt -123.84 152.13 42.64 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.98 -177.193 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.408 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -129.98 118.61 21.89 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 114.946 -1.025 . . . . 0.0 109.16 177.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.473 ' HB2' ' HB2' ' A' ' 65' ' ' ASP . 0.7 OUTLIER -124.26 150.05 45.78 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -174.74 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.584 ' N ' ' HD3' ' A' ' 62' ' ' ARG . 0.8 OUTLIER -97.89 176.43 5.79 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 120.953 0.406 . . . . 0.0 110.436 -176.154 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -54.01 -34.42 59.85 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.086 175.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.1 -45.72 90.14 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.981 177.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.473 ' HB2' ' HB2' ' A' ' 61' ' ' LEU . 5.1 m-20 -67.34 -41.68 84.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.064 178.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 62.1 tp -59.07 -37.82 77.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.822 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.97 -25.01 66.91 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.55 -178.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.493 HD23 HG13 ' A' ' 19' ' ' ILE . 81.8 mt -88.97 -15.83 33.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.236 -176.367 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.533 HD13 HD11 ' A' ' 32' ' ' LEU . 96.3 mt -110.33 143.2 40.91 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.965 0.412 . . . . 0.0 111.258 -175.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 20.4 m -101.57 114.1 27.84 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 172.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.532 ' CD2' HG12 ' A' ' 12' ' ' ILE . 75.0 mt -111.4 143.8 41.63 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.212 -174.517 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.501 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 16.3 m -126.37 123.77 24.24 Favored Pre-proline 0 C--N 1.317 -0.818 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.215 173.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.501 ' HD3' ' HA ' ' A' ' 72' ' ' VAL . 13.5 Cg_exo -70.01 161.48 45.82 Favored 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 122.201 1.934 . . . . 0.0 112.427 -175.407 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.425 ' CD1' ' HB2' ' A' ' 9' ' ' SER . 66.9 mt -74.89 -38.88 61.76 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.007 171.539 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.2 t70 . . . . . 0 C--O 1.25 1.096 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.211 -178.821 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 31.8 t . . . . . 0 N--CA 1.452 -0.357 0 CA-C-O 120.675 0.274 . . . . 0.0 110.496 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 47.1 mtp180 -128.64 167.68 16.84 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 120.816 0.341 . . . . 0.0 110.91 -178.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.49 ' HB2' HD11 ' A' ' 74' ' ' LEU . 21.7 m -121.93 142.89 49.82 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.058 0.456 . . . . 0.0 111.621 -173.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.416 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 73.2 m-85 -123.11 135.71 54.49 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.001 179.222 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.511 ' HG3' HG22 ' A' ' 72' ' ' VAL . 34.5 ptt180 -107.06 154.24 21.42 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.071 0.462 . . . . 0.0 110.48 179.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.432 HG12 ' CD2' ' A' ' 71' ' ' LEU . 26.6 mt -99.21 114.54 37.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.624 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 12.3 t -89.51 -18.44 26.66 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.755 0.312 . . . . 0.0 110.91 -177.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.567 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 167.39 -168.24 40.39 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.855 -0.688 . . . . 0.0 111.569 179.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -102.02 155.8 17.95 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.969 0.384 . . . . 0.0 110.315 177.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.496 ' O ' HG23 ' A' ' 19' ' ' ILE . 23.5 m -76.68 145.01 74.25 Favored Pre-proline 0 N--CA 1.442 -0.854 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.598 175.169 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -62.91 0.39 1.61 Allowed 'Trans proline' 0 N--CA 1.477 0.512 0 C-N-CA 123.21 2.607 . . . . 0.0 114.088 -173.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.94 3.63 54.74 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.764 0.316 . . . . 0.0 111.151 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.496 HG23 ' O ' ' A' ' 16' ' ' SER . 15.4 tt -84.63 124.59 39.98 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-O 121.371 0.605 . . . . 0.0 110.793 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.2 m -156.12 -176.08 5.77 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.985 -177.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 66.2 t30 64.01 29.27 14.34 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 122.949 0.5 . . . . 0.0 112.06 170.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 81.8 5.56 89.72 Favored Glycine 0 N--CA 1.454 -0.166 0 C-N-CA 121.13 -0.557 . . . . 0.0 113.141 176.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -61.4 -26.46 67.87 Favored 'General case' 0 C--N 1.33 -0.262 0 O-C-N 122.704 -0.292 . . . . 0.0 111.631 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.442 ' HA ' HD11 ' A' ' 19' ' ' ILE . 12.3 ttm180 -64.97 -40.53 95.12 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.826 0.346 . . . . 0.0 110.198 178.336 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -61.66 -43.92 97.94 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.279 178.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.44 ' HG2' ' HE2' ' A' ' 30' ' ' MET . 40.4 ttm180 -60.65 -42.88 97.86 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.296 178.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 75.7 mt -70.26 -41.59 73.27 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.497 -178.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -60.35 -46.41 90.03 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.261 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 74.5 m -65.59 -28.35 69.07 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.588 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' MET . . . . . 0.44 ' HE2' ' HG2' ' A' ' 26' ' ' ARG . 69.4 mtm -85.04 -9.26 58.18 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.959 178.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 96.34 24.44 14.31 Favored Glycine 0 C--N 1.33 0.218 0 C-N-CA 120.932 -0.651 . . . . 0.0 112.992 174.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.601 HD11 HD12 ' A' ' 69' ' ' LEU . 84.8 mt -112.28 94.09 4.76 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.897 0.379 . . . . 0.0 110.196 179.387 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -137.96 159.61 67.85 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.381 -178.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.567 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 17.9 Cg_exo -66.23 138.73 52.49 Favored 'Trans proline' 0 N--CA 1.464 -0.256 0 C-N-CA 122.512 2.142 . . . . 0.0 111.495 177.46 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 100.65 -1.02 55.48 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.675 -0.774 . . . . 0.0 111.863 -177.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -103.43 -174.76 2.62 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 176.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.428 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -159.79 151.25 19.87 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.717 -176.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.576 HD11 HG21 ' A' ' 52' ' ' VAL . 85.4 mt -131.86 138.48 48.47 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.618 178.714 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 -110.37 127.43 55.06 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.924 -178.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 8.5 p -65.5 126.04 23.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.351 0.596 . . . . 0.0 111.216 -175.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.602 HG12 ' HG3' ' A' ' 42' ' ' ARG . 65.2 t -96.83 -57.72 4.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.43 -0.804 . . . . 0.0 109.587 172.363 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.602 ' HG3' HG12 ' A' ' 41' ' ' VAL . 57.3 mtp180 -146.93 158.84 44.03 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.597 -179.189 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 61.2 mt -117.71 141.26 37.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.452 ' HB2' ' O ' ' A' ' 48' ' ' ASP . . . -72.21 150.8 92.21 Favored Pre-proline 0 C--O 1.233 0.222 0 CA-C-O 120.606 0.241 . . . . 0.0 110.859 178.851 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -54.89 -18.39 16.37 Favored 'Trans proline' 0 CA--C 1.535 0.534 0 C-N-CA 123.657 2.904 . . . . 0.0 114.854 -174.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 77.5 mt -103.41 -31.53 9.96 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 -175.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 118.18 -27.99 7.12 Favored Glycine 0 N--CA 1.453 -0.178 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 -171.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.805 ' HB3' ' HD2' ' A' ' 49' ' ' PRO . 0.2 OUTLIER -61.16 170.32 1.67 Allowed Pre-proline 0 C--O 1.221 -0.439 0 CA-C-O 118.346 -0.835 . . . . 0.0 109.113 168.47 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.805 ' HD2' ' HB3' ' A' ' 48' ' ' ASP . 17.1 Cg_exo -18.67 150.77 0.0 OUTLIER 'Trans proline' 0 C--N 1.362 1.273 1 C-N-CA 126.582 4.855 . . . . 0.0 117.988 -153.623 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 67.0 mt -123.91 140.37 47.56 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.971 0 CA-C-N 113.579 -1.646 . . . . 0.0 110.103 -170.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -84.37 112.63 20.51 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 178.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.576 HG21 HD11 ' A' ' 38' ' ' LEU . 26.7 m -119.41 168.92 11.15 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 120.738 0.304 . . . . 0.0 110.729 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -125.83 142.61 51.43 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.025 -176.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 11.8 m -96.87 -59.5 1.79 Allowed 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 172.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -141.65 -35.22 0.46 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.175 -0.92 . . . . 0.0 109.39 176.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -151.21 -35.06 0.14 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.775 173.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 2.0 m -67.25 135.04 52.78 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.914 -178.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.45 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 5.6 m -96.96 133.31 41.78 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.045 176.305 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.5 mp -115.98 148.08 40.5 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.281 -179.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -145.56 114.15 6.78 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.904 177.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.536 HD12 HD13 ' A' ' 66' ' ' LEU . 2.9 pp -135.96 153.6 51.36 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.592 -178.17 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.598 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 24.2 mmt180 -64.49 166.53 8.27 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.496 0.665 . . . . 0.0 112.02 -176.057 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 56.8 mtm180 -75.06 -32.94 61.65 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.045 178.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -58.33 -39.8 80.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.827 173.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -75.49 -40.13 57.66 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.601 178.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.679 HD12 HD11 ' A' ' 71' ' ' LEU . 26.9 tp -64.12 -26.62 68.62 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.779 179.614 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.89 -19.67 65.03 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.413 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 96.1 mt -73.47 -25.06 60.31 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.959 0.409 . . . . 0.0 110.545 178.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.601 HD12 HD11 ' A' ' 32' ' ' LEU . 75.7 mt -98.11 130.99 44.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.168 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 27.0 m -89.25 114.29 25.62 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 174.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.679 HD11 HD12 ' A' ' 66' ' ' LEU . 83.0 mt -110.74 144.2 40.07 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.284 -171.33 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.511 HG22 ' HG3' ' A' ' 11' ' ' ARG . 5.1 m -136.62 135.38 20.38 Favored Pre-proline 0 C--N 1.318 -0.762 0 CA-C-N 115.045 -0.979 . . . . 0.0 109.028 171.35 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.416 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 5.4 Cg_exo -72.93 162.83 40.01 Favored 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 121.897 1.732 . . . . 0.0 112.167 -177.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.49 HD11 ' HB2' ' A' ' 9' ' ' SER . 74.8 mt -82.81 -36.02 25.91 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 171.002 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 34.0 t70 . . . . . 0 C--O 1.253 1.26 0 CA-C-N 114.336 -1.302 . . . . 0.0 109.234 170.714 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.434 ' HB3' HG11 ' A' ' 40' ' ' VAL . 22.8 t . . . . . 0 N--CA 1.45 -0.453 0 N-CA-C 109.789 -0.448 . . . . 0.0 109.789 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.437 ' O ' HG13 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -135.56 -179.93 5.95 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.936 0.398 . . . . 0.0 111.085 177.466 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.504 ' HB2' HD12 ' A' ' 74' ' ' LEU . 6.6 m -114.91 139.18 50.0 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.742 -177.112 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.451 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 36.3 m-85 -119.97 132.07 55.38 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.672 -178.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.403 ' HG3' HG21 ' A' ' 72' ' ' VAL . 1.9 ptp180 -96.68 148.72 22.59 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.025 0.441 . . . . 0.0 110.052 176.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.507 HD11 ' HB2' ' A' ' 36' ' ' ALA . 22.1 mt -92.91 114.3 29.45 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.14 -178.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 17.8 p -85.05 -22.58 28.93 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.946 0.403 . . . . 0.0 110.443 176.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 161.95 -150.35 19.65 Favored Glycine 0 N--CA 1.441 -0.972 0 C-N-CA 120.41 -0.9 . . . . 0.0 112.094 177.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -106.59 164.69 11.86 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 -179.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.418 ' HB2' ' O ' ' A' ' 67' ' ' ALA . 33.1 t -52.44 131.73 44.19 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 123.435 0.46 . . . . 0.0 110.767 175.388 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_exo -66.35 -5.01 11.67 Favored 'Trans proline' 0 C--N 1.343 0.245 0 C-N-CA 122.843 2.362 . . . . 0.0 112.243 178.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -122.09 26.42 8.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.71 178.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 18.4 tt -72.03 151.96 8.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 177.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 26.5 t -130.39 160.04 35.19 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 120.976 0.417 . . . . 0.0 111.77 -171.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.6 m120 63.77 -105.55 0.15 Allowed 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.923 172.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -148.68 27.61 1.32 Allowed Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.017 -177.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -65.74 -27.75 68.54 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 7.1 ttm180 -56.75 -42.64 79.68 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.383 175.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -68.68 -34.56 75.87 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.579 -178.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.1 tpp180 -61.94 -47.86 83.01 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.296 0.57 . . . . 0.0 109.749 173.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 97.8 mt -66.38 -41.77 88.91 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.53 -177.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -59.39 -45.22 92.06 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.558 -0.747 . . . . 0.0 110.32 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 45.9 m -65.01 -34.36 78.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.746 179.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' MET . . . . . 0.9 ' HA ' ' HE1' ' A' ' 30' ' ' MET . 10.3 mmt -73.1 -19.99 61.03 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.079 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 105.81 9.91 31.69 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.556 -0.831 . . . . 0.0 112.132 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.614 HD13 HD13 ' A' ' 69' ' ' LEU . 93.0 mt -98.52 97.94 9.19 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 178.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.8 pp -143.85 160.82 48.76 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.624 -176.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -60.96 133.25 46.36 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.513 2.142 . . . . 0.0 111.677 178.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 113.88 -17.15 20.4 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.328 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.507 ' HB2' HD11 ' A' ' 12' ' ' ILE . . . -93.27 -178.22 4.69 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-O 121.274 0.559 . . . . 0.0 110.323 179.14 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -149.1 151.88 35.19 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.287 -177.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 71.3 mt -129.24 138.17 51.51 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.211 0.529 . . . . 0.0 110.612 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 34.6 ttm180 -98.01 116.07 29.48 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.129 175.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.53 ' HA ' HG11 ' A' ' 52' ' ' VAL . 7.9 p -67.01 128.16 29.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.222 0.534 . . . . 0.0 110.337 -178.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.88 HG11 ' HG3' ' A' ' 42' ' ' ARG . 46.8 t -98.91 -53.9 7.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.243 178.066 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.88 ' HG3' HG11 ' A' ' 41' ' ' VAL . 46.3 mtt180 -157.43 138.21 13.2 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -173.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.6 mp -112.35 106.61 21.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 157.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.508 ' HB2' ' HD3' ' A' ' 49' ' ' PRO . . . -53.16 128.89 49.53 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 120.582 0.23 . . . . 0.0 111.387 -173.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -61.25 -6.41 6.6 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 123.465 2.777 . . . . 0.0 112.666 -179.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.428 HD11 ' HA ' ' A' ' 46' ' ' LEU . 3.7 mm? -58.82 -34.53 71.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.343 172.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 164.9 -76.29 0.15 Allowed Glycine 0 CA--C 1.494 -1.235 0 N-CA-C 109.862 -1.295 . . . . 0.0 109.862 -175.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -176.19 119.92 0.3 Allowed Pre-proline 0 N--CA 1.449 -0.477 0 N-CA-C 114.266 1.21 . . . . 0.0 114.266 171.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.508 ' HD3' ' HB2' ' A' ' 44' ' ' ALA . 55.2 Cg_endo -115.47 166.32 0.03 OUTLIER 'Trans proline' 0 N--CA 1.438 -1.774 1 C-N-CA 125.736 4.291 . . . . 0.0 109.159 134.869 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.595 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 59.5 mt -116.84 100.32 10.09 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.703 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.979 179.708 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.469 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 35.8 mt-30 -92.74 115.38 28.06 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.423 179.605 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.53 HG11 ' HA ' ' A' ' 40' ' ' VAL . 19.8 m -131.53 171.92 17.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.486 -177.208 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -134.63 133.62 40.33 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 17.9 m -82.95 -73.02 0.42 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.779 0.323 . . . . 0.0 111.071 -177.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.477 ' HD2' ' O ' ' A' ' 55' ' ' ARG . 7.4 tmm_? -167.82 23.36 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.429 ' HB2' ' O ' ' A' ' 55' ' ' ARG . 8.4 tt0 171.59 -29.76 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.553 -175.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.5 t -130.24 143.93 51.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.146 -175.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 34.7 t -103.31 146.24 28.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.386 0.612 . . . . 0.0 110.762 -178.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.469 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 2.7 mm? -128.32 166.96 17.63 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.161 -178.496 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.595 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -149.39 133.94 17.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.85 179.129 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -151.59 174.34 13.56 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -175.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.475 ' HD2' ' N ' ' A' ' 62' ' ' ARG . 8.4 mpt_? -104.88 167.1 9.93 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 120.891 0.376 . . . . 0.0 111.363 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -43.98 -56.71 3.77 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 115.08 -0.964 . . . . 0.0 112.902 177.8 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -56.0 -40.12 72.89 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.272 0.558 . . . . 0.0 111.149 -176.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -70.76 -31.23 67.96 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.166 -176.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.439 HD13 HD12 ' A' ' 71' ' ' LEU . 18.2 tp -68.26 -39.49 82.18 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.295 176.408 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.418 ' O ' ' HB2' ' A' ' 16' ' ' SER . . . -63.91 -14.11 50.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.859 -177.556 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 83.8 mt -80.33 -16.49 54.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.985 0.421 . . . . 0.0 110.68 177.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.614 HD13 HD13 ' A' ' 32' ' ' LEU . 80.2 mt -109.2 151.35 26.6 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.018 176.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 26.3 m -107.5 114.26 28.15 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.351 0.596 . . . . 0.0 109.996 172.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.502 ' CD2' HG12 ' A' ' 12' ' ' ILE . 58.7 mt -122.45 137.48 54.86 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.162 -0.927 . . . . 0.0 110.335 -175.277 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.433 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 27.6 m -127.91 137.04 29.95 Favored Pre-proline 0 C--N 1.322 -0.605 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 174.746 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.451 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 13.6 Cg_exo -68.32 163.15 37.47 Favored 'Trans proline' 0 N--CA 1.463 -0.319 0 C-N-CA 122.124 1.883 . . . . 0.0 111.911 -178.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.504 HD12 ' HB2' ' A' ' 9' ' ' SER . 78.8 mt -79.43 -37.02 38.04 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.359 0.6 . . . . 0.0 110.156 175.078 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 29.7 t70 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.269 -0.872 . . . . 0.0 109.882 177.879 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 36.6 t . . . . . 0 N--CA 1.452 -0.356 0 CA-C-O 120.697 0.284 . . . . 0.0 110.548 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 53.5 mtp180 -135.44 161.49 35.32 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.046 0.451 . . . . 0.0 110.839 -176.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.5 ' HB2' HD12 ' A' ' 74' ' ' LEU . 19.8 m -118.51 141.83 48.19 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.796 179.011 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.475 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 4.6 m-85 -130.02 133.11 46.52 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.25 -174.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.583 ' HG2' ' HB1' ' A' ' 37' ' ' ALA . 55.7 mtt-85 -89.1 159.03 17.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.071 0.462 . . . . 0.0 110.751 177.092 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 40.0 mt -100.55 111.39 30.09 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.07 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.561 ' HG1' HG12 ' A' ' 72' ' ' VAL . 0.2 OUTLIER -77.24 -27.21 53.24 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.458 0.647 . . . . 0.0 110.256 179.345 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.551 ' HA2' ' HB3' ' A' ' 34' ' ' PRO . . . 153.61 -149.83 21.4 Favored Glycine 0 N--CA 1.441 -0.975 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.481 -177.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.592 ' CE1' ' HG3' ' A' ' 24' ' ' ARG . 19.5 m-85 -118.11 151.62 37.2 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 -179.307 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.525 ' O ' HG21 ' A' ' 19' ' ' ILE . 25.2 m -64.4 143.05 98.48 Favored Pre-proline 0 N--CA 1.447 -0.581 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 178.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 26.0 Cg_exo -62.69 -0.42 1.97 Allowed 'Trans proline' 0 CA--C 1.532 0.424 0 C-N-CA 123.268 2.646 . . . . 0.0 113.901 -173.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.75 -6.59 39.38 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.755 0.312 . . . . 0.0 111.463 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.525 HG21 ' O ' ' A' ' 16' ' ' SER . 12.7 tt -88.01 148.51 4.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 120.974 0.416 . . . . 0.0 110.647 -177.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.488 ' HB3' ' HD2' ' A' ' 23' ' ' TYR . 13.2 t -89.33 162.81 15.62 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.957 179.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -69.71 -40.59 76.17 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 -173.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.39 -33.94 86.43 Favored Glycine 0 CA--C 1.517 0.214 0 C-N-CA 120.422 -0.894 . . . . 0.0 112.037 177.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.488 ' HD2' ' HB3' ' A' ' 20' ' ' SER . 41.1 m-85 -67.15 -38.75 86.05 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 120.782 0.325 . . . . 0.0 110.319 175.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.592 ' HG3' ' CE1' ' A' ' 15' ' ' TYR . 20.2 ttm180 -59.24 -43.34 92.38 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.899 175.235 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -64.42 -37.14 86.5 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.368 -178.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 62.2 ttt180 -72.38 -36.53 68.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.207 178.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.407 HD23 ' CE ' ' A' ' 30' ' ' MET . 73.8 mt -68.76 -43.37 75.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.411 179.038 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -58.78 -45.39 89.92 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.92 178.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 64.9 m -64.32 -31.6 72.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.588 179.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' MET . . . . . 0.407 ' CE ' HD23 ' A' ' 27' ' ' LEU . 71.7 mtm -81.33 -15.11 56.34 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.692 -179.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 116.96 6.92 13.43 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.406 -0.902 . . . . 0.0 113.611 174.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.4 mt -105.42 98.02 7.78 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 178.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -128.95 150.76 76.14 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.258 -174.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.551 ' HB3' ' HA2' ' A' ' 14' ' ' GLY . 37.9 Cg_endo -66.23 135.01 38.46 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.807 2.338 . . . . 0.0 111.534 178.39 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 107.16 -19.73 34.3 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.332 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.32 -171.41 3.56 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-O 121.327 0.584 . . . . 0.0 110.57 -178.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.583 ' HB1' ' HG2' ' A' ' 11' ' ' ARG . . . -148.22 135.9 20.76 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.287 -177.13 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.462 HD11 HG21 ' A' ' 52' ' ' VAL . 51.0 mt -108.8 131.88 54.54 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.159 0.504 . . . . 0.0 110.523 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 6.4 ttp85 -101.94 123.43 45.85 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.321 -0.854 . . . . 0.0 108.831 175.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.566 ' HA ' HG11 ' A' ' 52' ' ' VAL . 10.8 p -69.13 127.2 30.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 121.405 0.622 . . . . 0.0 111.391 -175.308 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.5 t -88.44 -50.64 13.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.761 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.927 174.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 38.9 ttm180 -175.18 142.97 0.65 Allowed 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.192 0.52 . . . . 0.0 112.033 -178.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 98.0 mt -100.86 140.57 19.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 168.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.707 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -82.64 147.93 56.86 Favored Pre-proline 0 C--N 1.324 -0.528 0 O-C-N 122.247 -0.283 . . . . 0.0 111.087 -178.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -67.18 -2.05 7.37 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 123.25 2.633 . . . . 0.0 112.915 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.429 HD22 ' HA ' ' A' ' 46' ' ' LEU . 1.0 OUTLIER -56.57 -38.92 72.63 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 122.153 0.978 . . . . 0.0 109.448 174.921 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.544 ' O ' ' HB2' ' A' ' 48' ' ' ASP . . . 153.18 -55.0 0.44 Allowed Glycine 0 N--CA 1.434 -1.489 0 N-CA-C 108.289 -1.924 . . . . 0.0 108.289 -170.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.544 ' HB2' ' O ' ' A' ' 47' ' ' GLY . 13.0 t70 169.24 120.31 0.04 OUTLIER Pre-proline 0 N--CA 1.452 -0.373 0 O-C-N 125.155 1.15 . . . . 0.0 113.075 168.318 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.707 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 27.8 Cg_endo -109.94 163.53 0.07 OUTLIER 'Trans proline' 0 N--CA 1.433 -2.038 1 C-N-CA 125.307 4.005 . . . . 0.0 108.097 137.324 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.782 HG23 HG13 ' A' ' 52' ' ' VAL . 30.8 mt -115.87 103.97 16.02 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 C-N-CA 119.31 -0.956 . . . . 0.0 110.672 -177.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.46 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 97.9 mt-30 -84.63 113.17 21.08 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 173.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.782 HG13 HG23 ' A' ' 50' ' ' ILE . 15.5 m -132.98 165.68 31.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 120.887 0.375 . . . . 0.0 111.481 -177.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -147.26 141.04 25.72 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.523 -0.918 . . . . 0.0 108.523 176.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 8.9 t -95.89 -47.7 6.03 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.169 -0.612 . . . . 0.0 109.699 176.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 55' ' ' ARG . 13.9 ptt180 177.24 24.04 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.474 0.71 . . . . 0.0 109.554 175.105 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -127.32 -65.71 0.92 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.082 -172.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.3 t -164.47 153.73 13.47 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.052 -178.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 10.5 m -71.89 141.39 49.54 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.135 0.493 . . . . 0.0 111.139 -179.415 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.46 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 65.8 tp -139.9 144.6 37.23 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.031 178.177 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.408 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -112.56 141.39 46.38 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.605 179.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.577 HD12 HD13 ' A' ' 50' ' ' ILE . 4.0 pp -142.29 161.43 38.05 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 -179.208 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.661 ' HD3' ' OD2' ' A' ' 65' ' ' ASP . 2.8 mpt_? -96.75 175.37 6.39 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.005 0.431 . . . . 0.0 109.979 -177.22 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.1 mmt180 -66.2 -33.52 75.95 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.508 177.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -66.87 -35.3 79.7 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.664 177.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.661 ' OD2' ' HD3' ' A' ' 62' ' ' ARG . 41.4 m-20 -68.23 -42.5 79.64 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-O 121.422 0.629 . . . . 0.0 109.366 175.111 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 45.5 tp -60.21 -32.37 71.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.875 178.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.84 -21.57 66.48 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.453 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 89.6 mt -86.03 -18.61 32.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.92 0.39 . . . . 0.0 110.996 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 88.7 mt -104.39 141.85 35.61 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.709 -177.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 20.2 m -101.29 115.67 31.03 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 172.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 73.2 mt -117.83 147.69 42.81 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.246 -176.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.561 HG12 ' HG1' ' A' ' 13' ' ' THR . 4.6 m -128.26 115.33 20.02 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.645 172.287 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.475 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 21.9 Cg_exo -65.31 161.62 36.94 Favored 'Trans proline' 0 N--CA 1.464 -0.251 0 C-N-CA 122.134 1.889 . . . . 0.0 112.323 -177.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.519 HD21 ' HG3' ' A' ' 11' ' ' ARG . 97.6 mt -93.56 -15.48 25.4 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 121.341 0.591 . . . . 0.0 109.705 176.413 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.4 t70 . . . . . 0 C--O 1.244 0.809 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.407 176.739 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.6 t . . . . . 0 N--CA 1.455 -0.181 0 CA-C-O 120.868 0.366 . . . . 0.0 111.079 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -103.71 173.21 6.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.621 0.724 . . . . 0.0 112.057 -172.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.434 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 13.4 t -137.92 140.42 40.3 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.66 172.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -123.87 129.11 50.47 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.261 -175.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.42 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 36.3 mtt-85 -88.96 146.84 24.64 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 177.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.505 HG12 ' CD2' ' A' ' 71' ' ' LEU . 36.7 mt -90.91 111.59 23.88 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 175.429 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 18.5 m -79.08 -22.24 45.58 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.341 0.591 . . . . 0.0 110.336 178.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.648 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 156.94 -142.78 8.96 Favored Glycine 0 N--CA 1.443 -0.873 0 C-N-CA 120.834 -0.698 . . . . 0.0 111.785 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.519 ' HB3' HG22 ' A' ' 19' ' ' ILE . 34.0 m-85 -121.82 151.16 40.92 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.629 ' O ' HG21 ' A' ' 19' ' ' ILE . 74.3 p -69.59 159.16 84.89 Favored Pre-proline 0 N--CA 1.445 -0.68 0 CA-C-O 120.683 0.278 . . . . 0.0 111.002 -177.226 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_exo -73.44 11.57 0.99 Allowed 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 122.533 2.155 . . . . 0.0 111.961 174.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.415 ' H ' ' C ' ' A' ' 16' ' ' SER . . . -103.77 -14.26 16.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.766 179.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.629 HG21 ' O ' ' A' ' 16' ' ' SER . 13.0 tt -89.43 142.96 12.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 120.77 0.319 . . . . 0.0 110.166 179.572 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.7 t -161.36 -174.69 4.41 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.624 0.25 . . . . 0.0 110.368 -174.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.1 t30 59.15 34.91 23.49 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.284 0.634 . . . . 0.0 111.793 174.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.39 6.0 87.84 Favored Glycine 0 CA--C 1.519 0.293 0 C-N-CA 120.838 -0.696 . . . . 0.0 114.011 174.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -62.22 -22.83 66.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 117.31 0.555 . . . . 0.0 110.889 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.477 ' HG2' ' CG ' ' A' ' 15' ' ' TYR . 34.6 mtt85 -63.95 -42.84 97.18 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.746 174.655 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -66.88 -35.79 80.83 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 121.231 0.539 . . . . 0.0 109.802 177.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 86.1 mtt180 -62.13 -44.14 97.28 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.814 176.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.604 HD21 HD12 ' A' ' 32' ' ' LEU . 38.2 mt -69.56 -41.71 75.5 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.493 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -58.14 -47.44 83.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.415 178.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 59.3 m -63.34 -28.68 70.17 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.571 -179.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 67.9 mtm -84.71 -12.99 52.68 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.424 178.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 114.76 -0.28 23.1 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.471 -0.871 . . . . 0.0 113.261 174.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.799 HD11 HD13 ' A' ' 69' ' ' LEU . 88.7 mt -96.05 100.44 12.1 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.968 0.413 . . . . 0.0 110.107 -178.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 pp -138.89 155.42 73.09 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.069 -175.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.648 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 23.0 Cg_exo -64.4 137.61 56.39 Favored 'Trans proline' 0 C--O 1.234 0.308 0 C-N-CA 122.9 2.4 . . . . 0.0 112.052 179.528 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 111.04 -28.12 10.14 Favored Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.313 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.03 154.08 21.04 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-O 121.122 0.486 . . . . 0.0 110.105 -179.041 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.42 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -129.94 138.17 50.74 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.973 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.632 ' HB3' ' HB ' ' A' ' 52' ' ' VAL . 2.2 mm? -106.87 142.19 36.9 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.268 179.803 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 35.5 ttt180 -94.16 132.85 38.28 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 173.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.564 ' HA ' HG13 ' A' ' 52' ' ' VAL . 7.6 p -71.64 128.28 34.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.157 0.504 . . . . 0.0 111.084 -175.597 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.0 t -99.35 -44.87 11.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.611 176.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 57.9 ttt180 -176.52 135.79 0.25 Allowed 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 -177.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.8 mp -116.6 128.76 73.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 166.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.12 125.49 91.05 Favored Pre-proline 0 C--N 1.32 -0.675 0 C-N-CA 121.048 -0.261 . . . . 0.0 110.442 176.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -57.36 -14.45 15.98 Favored 'Trans proline' 0 N--CA 1.475 0.428 0 C-N-CA 123.426 2.751 . . . . 0.0 113.107 -179.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 46' ' ' LEU . 3.9 mm? -54.92 -33.24 61.95 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.315 176.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 164.37 -75.64 0.16 Allowed Glycine 0 N--CA 1.435 -1.419 0 N-CA-C 110.981 -0.848 . . . . 0.0 110.981 -177.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -164.68 118.53 0.99 Allowed Pre-proline 0 N--CA 1.443 -0.818 0 N-CA-C 114.522 1.304 . . . . 0.0 114.522 179.364 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -118.61 -175.5 0.02 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.714 1 C-N-CA 126.994 5.129 . . . . 0.0 107.988 132.738 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.5 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 67.3 mt -145.11 104.43 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.237 0 C-N-CA 120.117 -0.633 . . . . 0.0 109.882 173.253 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.44 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 8.9 tt0 -92.96 120.64 33.49 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 174.233 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.632 ' HB ' ' HB3' ' A' ' 38' ' ' LEU . 7.6 m -140.53 162.02 23.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.777 0.322 . . . . 0.0 111.025 -176.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -119.12 135.61 54.57 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.024 -0.534 . . . . 0.0 109.689 -178.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.0 t -88.91 -33.12 17.4 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.704 -0.399 . . . . 0.0 110.044 179.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 35.1 ttm180 178.24 -61.25 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.308 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -107.31 -38.33 5.99 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.513 178.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.0 t -109.0 150.2 28.1 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.901 0.381 . . . . 0.0 110.845 -174.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.2 p -114.38 144.91 42.53 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.649 179.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.44 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 6.2 mp -127.45 162.01 27.38 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.987 -176.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.5 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -131.41 142.18 49.98 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.858 177.097 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.471 HD12 ' HB2' ' A' ' 65' ' ' ASP . 3.9 pp -153.82 177.34 11.11 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 -174.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.402 ' HD2' ' O ' ' A' ' 61' ' ' LEU . 15.1 mmm-85 -121.92 -175.04 3.02 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.931 0.872 . . . . 0.0 111.521 -178.673 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.0 ptp180 -56.04 -34.0 65.47 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 113.757 -1.565 . . . . 0.0 111.669 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -63.11 -44.61 95.15 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.478 179.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.471 ' HB2' HD12 ' A' ' 61' ' ' LEU . 7.7 m-20 -67.63 -39.45 84.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.246 0.546 . . . . 0.0 109.601 178.122 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 66.3 tp -60.03 -39.64 86.58 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.289 -0.868 . . . . 0.0 110.878 177.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.45 -12.84 61.61 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.231 -0.441 . . . . 0.0 112.118 -176.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.477 ' HB3' HD11 ' A' ' 19' ' ' ILE . 93.8 mt -93.32 -21.33 19.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.79 0.329 . . . . 0.0 110.81 179.459 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.799 HD13 HD11 ' A' ' 32' ' ' LEU . 96.9 mt -107.25 140.32 40.32 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.463 -175.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.5 m -91.27 112.29 24.14 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 169.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.505 ' CD2' HG12 ' A' ' 12' ' ' ILE . 82.6 mt -120.92 128.05 52.41 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.307 -174.485 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.409 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 34.9 m -124.93 133.03 24.45 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.119 176.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 72' ' ' VAL . 18.5 Cg_exo -65.04 163.29 29.2 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.087 1.858 . . . . 0.0 111.414 179.223 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 9' ' ' SER . 91.3 mt -53.81 -57.62 10.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.216 0.531 . . . . 0.0 109.714 173.562 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.6 t70 . . . . . 0 C--O 1.251 1.132 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.416 176.413 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.0 t . . . . . 0 N--CA 1.451 -0.414 0 CA-C-O 120.765 0.317 . . . . 0.0 111.597 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 47.8 ttt85 -111.12 144.57 40.05 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.56 -171.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.1 t -123.21 139.78 53.7 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.925 -178.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.625 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 8.3 m-85 -116.66 133.19 56.31 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -178.307 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.453 ' CZ ' HD21 ' A' ' 74' ' ' LEU . 11.2 ptp180 -102.73 157.91 16.62 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 175.654 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.479 HG12 ' CD2' ' A' ' 71' ' ' LEU . 19.6 mt -104.66 115.04 45.81 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.131 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.018 -178.381 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 1.5 p -93.05 -16.27 25.19 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.664 0.269 . . . . 0.0 111.255 178.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.534 ' HA2' ' HB3' ' A' ' 34' ' ' PRO . . . 165.13 -153.84 24.24 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.487 -0.863 . . . . 0.0 112.28 178.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.503 ' CE1' ' HD3' ' A' ' 34' ' ' PRO . 60.9 m-85 -119.86 153.32 36.0 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 -178.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.591 ' O ' HG21 ' A' ' 19' ' ' ILE . 29.2 m -67.89 138.47 92.85 Favored Pre-proline 0 N--CA 1.441 -0.875 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 176.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -65.98 6.82 0.42 Allowed 'Trans proline' 0 CA--C 1.532 0.415 0 C-N-CA 122.771 2.314 . . . . 0.0 113.481 -175.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.41 ' H ' ' C ' ' A' ' 16' ' ' SER . . . -106.39 7.77 31.29 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.705 179.053 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.591 HG21 ' O ' ' A' ' 16' ' ' SER . 13.5 tt -96.97 132.87 40.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 CA-C-O 121.034 0.445 . . . . 0.0 110.464 177.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.9 t -156.75 -161.54 1.11 Allowed 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 -176.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 67.51 16.55 9.96 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.652 0.739 . . . . 0.0 110.924 175.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 79.69 4.05 89.23 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.51 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -66.11 -27.67 68.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.223 0.535 . . . . 0.0 110.245 -178.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 27.4 ttm180 -64.02 -41.95 97.27 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.023 176.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -69.69 -32.86 71.71 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.508 177.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -64.08 -43.33 95.75 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.997 0.427 . . . . 0.0 109.969 175.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.543 HD21 HD11 ' A' ' 32' ' ' LEU . 57.8 mt -64.3 -45.69 86.87 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.092 176.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -56.69 -45.33 81.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.417 178.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 48.8 m -63.19 -33.38 75.34 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.048 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 71.5 mtm -81.79 -10.44 59.34 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.434 -179.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 108.1 5.0 33.2 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.661 -0.78 . . . . 0.0 113.138 174.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.576 HD13 HD11 ' A' ' 69' ' ' LEU . 97.5 mt -94.0 91.0 6.66 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 177.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.8 pp -135.75 157.85 75.32 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.336 -174.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.534 ' HB3' ' HA2' ' A' ' 14' ' ' GLY . 32.3 Cg_endo -65.69 124.01 12.18 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.698 2.265 . . . . 0.0 111.627 177.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.56 -7.41 17.95 Favored Glycine 0 N--CA 1.444 -0.819 0 C-N-CA 120.818 -0.706 . . . . 0.0 111.843 -176.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.4 ' HB2' HD11 ' A' ' 12' ' ' ILE . . . -97.27 -172.52 2.44 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-O 120.985 0.422 . . . . 0.0 110.553 178.189 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.444 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -160.13 149.71 17.86 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.654 -176.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 58.8 mt -125.22 138.53 54.12 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.781 178.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 36.9 ttp180 -111.5 124.22 51.84 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 176.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.526 ' HA ' HG12 ' A' ' 52' ' ' VAL . 7.4 p -61.58 127.79 21.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-O 121.109 0.481 . . . . 0.0 112.11 -174.458 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 92.7 t -102.71 -50.9 9.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.917 171.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.9 ptm180 -170.67 161.05 7.37 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.122 0.487 . . . . 0.0 111.785 -178.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 82.5 mt -135.1 143.19 37.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 171.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.673 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -69.13 142.34 92.78 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 117.88 0.309 . . . . 0.0 110.841 179.065 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 22.7 Cg_exo -66.06 -8.92 21.52 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 123.184 2.589 . . . . 0.0 113.25 -177.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.409 HD13 ' HA ' ' A' ' 46' ' ' LEU . 4.0 mm? -65.86 -88.48 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.643 0.735 . . . . 0.0 110.443 176.644 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -123.95 -74.53 0.27 Allowed Glycine 0 CA--C 1.491 -1.444 0 N-CA-C 109.425 -1.47 . . . . 0.0 109.425 172.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.449 ' OD2' ' HB3' ' A' ' 63' ' ' ARG . 4.9 p-10 -178.44 124.41 0.26 Allowed Pre-proline 0 N--CA 1.44 -0.955 0 N-CA-C 113.995 1.109 . . . . 0.0 113.995 174.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.673 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 15.1 Cg_endo -105.45 157.82 0.16 Allowed 'Trans proline' 0 N--CA 1.437 -1.812 0 C-N-CA 125.005 3.803 . . . . 0.0 107.458 136.539 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.605 HG21 HG11 ' A' ' 52' ' ' VAL . 4.5 mp -119.8 104.88 16.29 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.706 0 C-N-CA 118.988 -1.085 . . . . 0.0 110.365 -175.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.439 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 26.1 mp0 -88.65 117.85 27.9 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.078 174.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.605 HG11 HG21 ' A' ' 50' ' ' ILE . 14.1 m -132.94 172.44 16.46 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.51 -178.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.5 ' HG2' ' H ' ' A' ' 55' ' ' ARG . 34.0 tt0 -117.58 130.83 56.64 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.004 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 17.8 p -92.53 17.89 9.41 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.088 -179.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.5 ' H ' ' HG2' ' A' ' 53' ' ' GLU . 0.0 OUTLIER 63.32 21.09 12.63 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.818 0.818 . . . . 0.0 109.005 -173.935 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -141.72 -62.37 0.46 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.993 -1.003 . . . . 0.0 108.512 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.7 t -142.92 174.72 10.42 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.679 178.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 17.8 m -82.49 143.45 31.11 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.99 0.424 . . . . 0.0 110.331 178.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.439 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 43.8 tp -134.14 144.62 48.65 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.572 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.534 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -133.07 139.72 47.3 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.74 -0.663 . . . . 0.0 109.574 177.604 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.0 pp -154.84 178.81 9.73 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -176.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 25.6 mmt85 -115.73 170.55 8.37 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 121.92 0.866 . . . . 0.0 112.206 -178.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.449 ' HB3' ' OD2' ' A' ' 48' ' ' ASP . 13.1 ptt-85 -62.14 -36.15 80.91 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 113.611 -1.631 . . . . 0.0 111.766 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.425 ' HE3' ' HB3' ' A' ' 64' ' ' LYS . 1.3 tmmt? -58.16 -45.85 86.74 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.923 0.392 . . . . 0.0 110.624 178.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -71.74 -37.75 70.52 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.324 0.583 . . . . 0.0 110.137 178.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 18.7 tp -64.12 -33.25 75.34 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.78 -179.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.27 -18.37 63.13 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.777 -178.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.414 ' HB3' HD12 ' A' ' 19' ' ' ILE . 91.2 mt -88.76 -7.49 56.14 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.757 0.313 . . . . 0.0 110.959 -179.701 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.576 HD11 HD13 ' A' ' 32' ' ' LEU . 94.7 mt -103.49 141.75 35.46 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.545 178.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 25.1 m -96.77 114.52 26.16 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 172.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.479 ' CD2' HG12 ' A' ' 12' ' ' ILE . 74.5 mt -121.79 134.98 54.91 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.047 -172.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.448 ' O ' ' HG2' ' A' ' 11' ' ' ARG . 17.1 m -127.61 128.48 23.94 Favored Pre-proline 0 C--N 1.319 -0.725 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 170.573 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.625 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 36.9 Cg_endo -65.63 163.4 30.36 Favored 'Trans proline' 0 C--O 1.234 0.29 0 C-N-CA 122.526 2.151 . . . . 0.0 113.545 -173.231 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.453 HD21 ' CZ ' ' A' ' 11' ' ' ARG . 95.7 mt -94.63 -71.77 0.65 Allowed 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.292 -0.867 . . . . 0.0 108.708 173.125 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 . . . . . 0 C--O 1.253 1.249 0 CA-C-O 117.748 -1.12 . . . . 0.0 109.304 175.603 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 23.4 t . . . . . 0 N--CA 1.448 -0.532 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 88.3 mtt180 -149.34 153.47 37.5 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 120.857 0.36 . . . . 0.0 110.775 177.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.484 ' HB2' HD12 ' A' ' 74' ' ' LEU . 2.2 m -95.79 135.56 37.35 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.921 179.414 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.515 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 44.8 m-85 -113.97 141.09 47.83 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.213 -177.712 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.534 ' HD2' HD21 ' A' ' 74' ' ' LEU . 45.4 mtp180 -97.96 144.94 26.98 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 178.652 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.427 HG12 ' CD2' ' A' ' 71' ' ' LEU . 18.7 mt -99.02 113.67 34.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 177.235 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 12.6 p -102.0 -3.63 27.4 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -175.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.486 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 160.46 -161.73 32.84 Favored Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 119.946 -1.121 . . . . 0.0 112.445 175.541 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -118.93 156.61 29.25 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.403 ' O ' HG22 ' A' ' 19' ' ' ILE . 36.9 t -66.1 137.36 95.74 Favored Pre-proline 0 C--N 1.319 -0.726 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 170.496 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -59.22 -14.81 25.77 Favored 'Trans proline' 0 CA--C 1.529 0.272 0 C-N-CA 122.838 2.359 . . . . 0.0 112.867 -176.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -78.3 -8.59 58.57 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.746 -178.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.403 HG22 ' O ' ' A' ' 16' ' ' SER . 15.7 tt -63.16 129.12 26.29 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-O 121.163 0.506 . . . . 0.0 110.523 179.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.3 t -134.21 178.16 7.19 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.318 -172.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 58.58 -158.99 0.29 Allowed 'General case' 0 CA--C 1.534 0.352 0 O-C-N 123.651 0.594 . . . . 0.0 109.59 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -94.09 25.62 21.11 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.817 -0.706 . . . . 0.0 111.782 176.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.433 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 4.9 t80 -64.48 -32.3 73.87 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.024 0.44 . . . . 0.0 110.154 -177.483 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 14.4 ttm180 -58.9 -42.11 88.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.464 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -65.61 -39.73 91.85 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.409 -179.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 34.1 ttt180 -66.17 -39.49 89.79 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.972 178.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 23' ' ' TYR . 85.2 mt -66.83 -44.3 81.44 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.349 179.298 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -57.62 -44.75 85.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.115 177.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 47.2 m -63.21 -34.17 77.06 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.172 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' MET . . . . . 0.898 ' HE2' ' HA ' ' A' ' 30' ' ' MET . 15.9 mmt -74.34 -24.67 59.22 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.848 -179.667 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.06 6.04 14.35 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.498 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.66 HD13 HD13 ' A' ' 69' ' ' LEU . 68.7 mt -97.66 90.86 5.15 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.2 pp -141.29 155.15 67.95 Favored Pre-proline 0 C--N 1.322 -0.604 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.065 -174.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.486 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 24.0 Cg_exo -63.72 127.05 18.71 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.815 2.343 . . . . 0.0 111.931 178.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.64 5.67 44.86 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.081 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -107.52 -179.45 3.92 Favored 'General case' 0 N--CA 1.442 -0.853 0 CA-C-O 120.968 0.413 . . . . 0.0 109.957 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -148.55 145.59 27.92 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.093 -177.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.462 HD13 HG21 ' A' ' 52' ' ' VAL . 45.6 mt -129.39 131.12 46.74 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.45 177.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.462 ' HA ' ' HA ' ' A' ' 9' ' ' SER . 38.3 ttm180 -100.61 118.84 37.58 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.222 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.548 ' HA ' HG13 ' A' ' 52' ' ' VAL . 7.5 p -65.32 131.09 31.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.56 0.695 . . . . 0.0 111.506 -174.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.733 HG13 ' HG3' ' A' ' 42' ' ' ARG . 59.2 t -95.84 -54.97 6.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.942 174.111 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.733 ' HG3' HG13 ' A' ' 41' ' ' VAL . 54.9 mtp180 -155.23 143.49 20.24 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -176.168 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.7 mp -114.87 119.43 61.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 161.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.405 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -56.91 127.87 75.77 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-O 120.525 0.202 . . . . 0.0 111.129 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 38.4 Cg_exo -62.33 -8.56 12.83 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 123.415 2.743 . . . . 0.0 112.61 -179.18 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -56.24 -38.36 70.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.554 173.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 170.52 -77.01 0.1 OUTLIER Glycine 0 N--CA 1.438 -1.172 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 -176.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -169.85 120.74 0.58 Allowed Pre-proline 0 N--CA 1.452 -0.361 0 CA-C-O 122.257 1.027 . . . . 0.0 113.666 177.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -117.96 -166.79 0.01 OUTLIER 'Trans proline' 0 N--CA 1.438 -1.786 1 C-N-CA 126.337 4.691 . . . . 0.0 107.777 139.206 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.687 HG21 HG12 ' A' ' 52' ' ' VAL . 54.5 mt -143.8 101.9 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.239 0 C-N-CA 120.255 -0.578 . . . . 0.0 109.628 168.124 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.496 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 54.2 mt-30 -87.91 119.09 27.93 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 175.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.687 HG12 HG21 ' A' ' 50' ' ' ILE . 17.7 m -132.68 171.88 17.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 120.802 0.335 . . . . 0.0 111.56 -175.379 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.443 ' HG3' ' H ' ' A' ' 55' ' ' ARG . 10.1 tp10 -138.82 141.19 38.71 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 176.201 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.1 t -124.13 18.53 9.16 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.639 0.733 . . . . 0.0 109.644 -176.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.443 ' H ' ' HG3' ' A' ' 53' ' ' GLU . 74.6 mtm180 74.52 23.7 1.87 Allowed 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.66 178.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -140.91 -52.92 0.47 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.275 0.56 . . . . 0.0 110.062 -178.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 59.9 m -153.84 135.67 14.54 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.472 -0.785 . . . . 0.0 109.428 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.5 m -76.65 131.52 38.89 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 175.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.496 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 3.0 mm? -121.64 171.75 8.61 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.98 0.419 . . . . 0.0 111.495 -176.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.537 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -146.25 141.79 27.72 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 174.172 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.45 ' C ' ' HD2' ' A' ' 62' ' ' ARG . 4.1 pp -146.18 155.45 42.72 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 120.693 -0.403 . . . . 0.0 110.167 -173.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.592 ' HD2' ' N ' ' A' ' 62' ' ' ARG . 4.2 mpt_? -104.39 164.79 11.49 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.585 -178.085 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 45.5 mtm180 -50.76 -36.05 34.8 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 114.858 -1.065 . . . . 0.0 112.925 -178.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -59.19 -49.33 78.26 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.761 0.315 . . . . 0.0 110.824 178.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -72.39 -34.37 67.88 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.035 0.445 . . . . 0.0 110.194 178.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 62.6 tp -62.71 -37.05 84.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.005 178.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.71 -18.56 65.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.731 -178.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 96.0 mt -94.77 -4.59 47.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.566 -178.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.66 HD13 HD13 ' A' ' 32' ' ' LEU . 92.1 mt -111.5 129.24 56.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.778 0.323 . . . . 0.0 111.521 -176.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.9 m -88.55 115.95 26.44 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 172.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.427 ' CD2' HG12 ' A' ' 12' ' ' ILE . 70.5 mt -124.93 135.33 52.74 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.021 -174.489 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 24.1 m -133.76 132.64 21.7 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.455 173.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.515 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 17.1 Cg_exo -66.07 164.05 29.06 Favored 'Trans proline' 0 CA--C 1.533 0.427 0 C-N-CA 122.48 2.12 . . . . 0.0 113.196 -175.398 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.534 HD21 ' HD2' ' A' ' 11' ' ' ARG . 39.2 mt -67.69 -26.32 66.12 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.207 175.631 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 37.1 t70 . . . . . 0 C--O 1.248 1.001 0 O-C-N 124.102 0.876 . . . . 0.0 110.707 -178.186 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.2 t . . . . . 0 N--CA 1.454 -0.244 0 CA-C-O 120.519 0.199 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -95.93 169.95 9.63 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.441 0.639 . . . . 0.0 111.78 -175.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.488 ' HB3' HD11 ' A' ' 74' ' ' LEU . 23.4 t -140.29 140.28 35.66 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 114.994 -1.003 . . . . 0.0 109.483 176.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.562 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 15.0 m-85 -121.14 128.33 52.43 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 -178.17 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.464 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 67.6 mtp180 -97.81 149.87 21.88 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.515 178.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 25.5 mt -88.08 117.2 31.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 8.8 t -94.8 -18.47 21.2 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.944 0.402 . . . . 0.0 110.271 -179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 166.89 -161.66 35.46 Favored Glycine 0 N--CA 1.443 -0.849 0 C-N-CA 120.449 -0.881 . . . . 0.0 112.269 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -105.81 158.35 16.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.677 0.275 . . . . 0.0 110.446 -178.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.445 ' O ' HG23 ' A' ' 19' ' ' ILE . 31.3 t -52.05 134.24 39.69 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.945 175.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 17.7 Cg_exo -67.77 2.53 2.44 Favored 'Trans proline' 0 C--O 1.235 0.374 0 C-N-CA 122.954 2.436 . . . . 0.0 112.649 178.5 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -115.52 6.7 14.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.916 178.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.445 HG23 ' O ' ' A' ' 16' ' ' SER . 10.8 tt -87.9 150.48 3.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.908 0.385 . . . . 0.0 110.812 -177.831 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 35.4 t -89.67 158.69 17.47 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.156 178.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.462 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 15.0 m120 -54.95 -44.3 74.2 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.237 -179.237 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.1 -36.67 92.22 Favored Glycine 0 C--N 1.329 0.173 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.833 -176.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -72.71 -31.19 64.82 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.43 ' HB3' ' O ' ' A' ' 21' ' ' ASN . 12.8 ttt180 -62.0 -43.79 98.1 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.746 172.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.462 ' HG3' ' O ' ' A' ' 21' ' ' ASN . 28.1 mt-30 -61.1 -41.88 97.48 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.565 177.182 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -57.83 -48.53 79.51 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.326 175.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.512 HD21 HD11 ' A' ' 32' ' ' LEU . 41.2 mt -67.55 -40.15 84.99 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.682 -176.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -60.34 -46.14 90.95 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.026 178.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 46.1 m -65.99 -31.49 72.42 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.141 179.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 82.5 mtp -71.03 -24.52 62.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.536 177.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 112.39 6.54 23.62 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.89 -0.671 . . . . 0.0 112.184 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.579 HD13 HD12 ' A' ' 69' ' ' LEU . 85.8 mt -98.31 97.3 8.69 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.989 0.423 . . . . 0.0 110.051 -178.272 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.4 pp -142.06 157.6 63.5 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.871 -176.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.66 139.38 88.59 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.731 2.287 . . . . 0.0 112.357 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 112.07 -21.07 20.87 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.328 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -85.53 -177.51 6.45 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 121.048 0.452 . . . . 0.0 110.35 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.464 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -159.65 134.93 8.22 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.91 -176.369 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.45 ' N ' HD22 ' A' ' 38' ' ' LEU . 2.2 mm? -108.55 141.18 40.85 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.622 176.486 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 20.5 ttm180 -109.09 127.72 54.38 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 176.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.537 ' HA ' HG11 ' A' ' 52' ' ' VAL . 9.9 p -67.27 127.71 29.29 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-O 121.309 0.576 . . . . 0.0 111.662 -172.6 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.8 t -106.73 -50.68 7.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.703 173.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.432 ' HE ' ' HB3' ' A' ' 42' ' ' ARG . 1.1 mtp180 -156.92 159.66 38.34 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -174.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 80.0 mt -127.45 142.53 43.33 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 162.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.596 ' H ' ' CD ' ' A' ' 49' ' ' PRO . . . -84.14 140.27 39.65 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-O 120.554 0.216 . . . . 0.0 111.523 -177.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -65.8 -7.39 16.5 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 123.107 2.538 . . . . 0.0 112.152 176.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.545 HD11 ' HB1' ' A' ' 44' ' ' ALA . 10.0 mp -57.76 -28.82 64.29 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.752 0.787 . . . . 0.0 110.336 173.36 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 153.95 -76.97 0.21 Allowed Glycine 0 N--CA 1.432 -1.633 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 -175.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -170.92 124.2 0.59 Allowed Pre-proline 0 N--CA 1.435 -1.195 0 CA-C-O 122.321 1.057 . . . . 0.0 113.094 174.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.596 ' CD ' ' H ' ' A' ' 44' ' ' ALA . 97.9 Cg_endo -115.04 -162.16 0.02 OUTLIER 'Trans proline' 0 N--CA 1.432 -2.146 1 C-N-CA 125.749 4.299 . . . . 0.0 107.686 143.3 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.775 HD12 HD12 ' A' ' 61' ' ' LEU . 52.5 mt -141.83 102.63 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.282 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 166.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -79.23 118.73 21.43 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 177.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.762 HG13 HG23 ' A' ' 50' ' ' ILE . 17.3 m -136.87 173.7 13.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-O 120.808 0.337 . . . . 0.0 111.313 -176.184 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -124.66 142.99 50.98 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 176.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 8.6 m -110.31 -39.25 5.02 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.683 -177.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 16.0 ptt180 179.46 -45.38 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.099 -0.5 . . . . 0.0 112.031 -177.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -132.27 -14.1 3.01 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -171.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.8 t -156.19 129.95 8.43 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.078 0.466 . . . . 0.0 110.279 -175.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.8 m -76.68 138.14 39.83 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.64 -177.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 16.6 mt -126.89 174.56 8.72 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.222 -175.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.442 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -134.78 161.24 35.73 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.35 178.392 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.775 HD12 HD12 ' A' ' 50' ' ' ILE . 4.2 pp -151.43 158.68 44.0 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 179.127 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.637 ' HD2' ' N ' ' A' ' 62' ' ' ARG . 6.3 mpt_? -109.32 176.35 5.12 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 -175.639 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -61.73 -38.27 87.28 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.032 178.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.44 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 55.0 tptt -64.53 -49.3 71.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.278 176.322 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -61.88 -39.33 91.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.587 179.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 55.6 tp -63.33 -37.82 88.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.817 178.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.66 -10.9 60.48 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.557 -178.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 64' ' ' LYS . 77.3 mt -87.07 -23.41 24.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.739 0.304 . . . . 0.0 111.05 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.579 HD12 HD13 ' A' ' 32' ' ' LEU . 95.7 mt -113.97 135.38 54.06 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.584 -178.64 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.9 m -90.4 115.85 27.89 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 174.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 80.2 mt -110.85 133.48 53.33 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.951 -175.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.3 m -114.55 114.87 44.71 Favored Pre-proline 0 C--N 1.319 -0.728 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.369 172.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.562 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 39.6 Cg_endo -68.31 163.0 38.05 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 121.988 1.792 . . . . 0.0 112.087 -177.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.488 HD11 ' HB3' ' A' ' 9' ' ' SER . 80.0 mt -76.28 1.76 15.17 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.412 175.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 32.5 t70 . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.408 -0.806 . . . . 0.0 109.808 178.131 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 18.9 t . . . . . 0 N--CA 1.447 -0.603 0 CA-C-O 120.454 0.169 . . . . 0.0 110.58 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.405 ' O ' HG13 ' A' ' 40' ' ' VAL . 86.8 mtt-85 -143.99 -174.91 4.4 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 121.108 0.48 . . . . 0.0 111.178 -172.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.456 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 17.8 m -101.44 144.97 29.58 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.083 -178.194 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.757 ' HE2' ' HB ' ' A' ' 40' ' ' VAL . 39.1 m-85 -121.61 128.13 51.61 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 177.307 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.45 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 98.3 mtt180 -90.25 155.81 18.74 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.569 -0.452 . . . . 0.0 110.584 178.349 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.7 mt -105.77 111.47 35.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.829 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 3.0 p -81.14 -21.3 39.91 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.896 0.379 . . . . 0.0 110.822 179.311 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.533 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 159.51 -144.49 10.23 Favored Glycine 0 N--CA 1.439 -1.11 0 C-N-CA 120.109 -1.044 . . . . 0.0 112.134 177.331 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.451 ' CB ' HG23 ' A' ' 19' ' ' ILE . 21.3 m-85 -123.96 157.82 33.47 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -177.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.492 ' O ' HG22 ' A' ' 19' ' ' ILE . 20.4 m -59.49 134.98 88.86 Favored Pre-proline 0 N--CA 1.447 -0.592 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 172.202 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -48.05 -29.78 12.87 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 123.723 2.949 . . . . 0.0 114.736 -173.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -88.18 10.51 19.18 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -174.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.492 HG22 ' O ' ' A' ' 16' ' ' SER . 17.2 tt -77.71 114.74 18.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.492 0.663 . . . . 0.0 109.991 176.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.531 ' O ' ' HB2' ' A' ' 21' ' ' ASN . 65.4 m -165.83 99.17 0.66 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.825 -172.599 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.531 ' HB2' ' O ' ' A' ' 20' ' ' SER . 3.7 t30 171.37 33.27 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 177.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 73.47 -1.15 45.2 Favored Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.149 -173.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -60.55 -32.26 71.34 Favored 'General case' 0 C--N 1.334 -0.075 0 CA-C-O 120.774 0.321 . . . . 0.0 111.066 -175.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 11.8 mtp180 -62.27 -41.87 98.84 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.723 176.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -67.76 -34.69 77.31 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 120.963 0.411 . . . . 0.0 110.301 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.445 ' HA ' ' HD2' ' A' ' 26' ' ' ARG . 16.5 tpt180 -64.26 -42.91 96.25 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.771 -0.65 . . . . 0.0 109.978 176.028 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.643 HD13 HD21 ' A' ' 69' ' ' LEU . 90.6 mt -70.36 -38.08 74.71 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.504 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -59.53 -40.51 87.41 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.792 175.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 50.3 m -67.85 -33.23 74.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.838 179.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' MET . . . . . 0.899 ' HE2' ' HA ' ' A' ' 30' ' ' MET . 10.6 mmt -73.7 -23.17 59.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.868 178.39 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 109.28 12.67 19.29 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.894 -0.669 . . . . 0.0 112.343 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.4 mt -101.32 95.51 6.56 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.888 0.375 . . . . 0.0 110.325 -179.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -130.88 154.74 82.02 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.288 -177.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.533 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 27.9 Cg_exo -61.48 119.49 6.66 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.722 2.281 . . . . 0.0 111.713 178.041 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.75 -7.12 17.68 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.773 -0.727 . . . . 0.0 111.996 -177.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -94.33 -171.96 2.66 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 120.984 0.421 . . . . 0.0 110.192 178.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.45 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -155.22 148.13 24.51 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.714 -177.014 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.532 HD11 HG22 ' A' ' 52' ' ' VAL . 33.0 mt -125.52 132.63 52.58 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 178.595 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 42.9 ttp180 -98.27 124.23 42.78 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 178.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.757 ' HB ' ' HE2' ' A' ' 10' ' ' TYR . 8.1 p -69.1 126.09 28.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.344 0.592 . . . . 0.0 111.416 -174.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 65.2 t -97.44 -44.58 12.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.353 177.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 78.8 ttt180 -165.41 135.55 3.64 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.868 0.366 . . . . 0.0 111.551 176.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.7 mp -90.77 129.33 41.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 172.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.421 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -64.62 131.45 95.12 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-O 120.656 0.265 . . . . 0.0 110.385 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 44.5 Cg_exo -58.31 -18.6 38.77 Favored 'Trans proline' 0 CA--C 1.532 0.404 0 C-N-CA 123.236 2.624 . . . . 0.0 113.093 -177.258 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -88.42 -20.46 25.22 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.334 -177.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 101.29 -13.56 58.48 Favored Glycine 0 C--O 1.235 0.177 0 N-CA-C 111.212 -0.755 . . . . 0.0 111.212 -173.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.602 ' HB3' ' HD2' ' A' ' 49' ' ' PRO . 0.5 OUTLIER -62.72 169.21 3.48 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 114.986 -0.607 . . . . 0.0 110.522 172.706 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.602 ' HD2' ' HB3' ' A' ' 48' ' ' ASP . 12.0 Cg_exo -29.07 151.68 0.01 OUTLIER 'Trans proline' 0 C--N 1.361 1.217 1 C-N-CA 125.335 4.024 . . . . 0.0 116.059 -170.786 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.493 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 60.0 mt -110.83 133.72 55.41 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 113.87 -1.514 . . . . 0.0 109.734 -173.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 -84.83 118.87 24.74 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.304 -179.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.532 HG22 HD11 ' A' ' 38' ' ' LEU . 27.6 m -128.92 167.12 24.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.1 178.337 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -129.29 151.0 50.42 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 -177.748 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 18.4 p -119.46 -64.28 1.29 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.627 -179.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 55' ' ' ARG . 38.7 ttp180 -168.62 18.45 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.57 -176.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -148.29 -51.28 0.17 Allowed 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -172.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.4 t -173.02 167.2 5.01 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 -175.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.401 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 1.8 p -81.76 126.35 31.72 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.293 0.568 . . . . 0.0 111.417 -176.425 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 53.0 tp -118.87 147.22 44.2 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.79 -178.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.53 ' HB2' ' HB2' ' A' ' 49' ' ' PRO . . . -110.93 127.14 55.38 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.752 0.311 . . . . 0.0 110.602 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.409 ' O ' ' HA ' ' A' ' 49' ' ' PRO . 2.7 pp -103.59 132.78 49.55 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.456 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.701 ' HD3' ' OD2' ' A' ' 65' ' ' ASP . 0.5 OUTLIER -75.49 174.45 9.63 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.069 0.461 . . . . 0.0 111.136 -170.715 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 23.0 mmm180 -62.19 -33.55 74.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.177 174.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -62.14 -52.75 62.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.841 177.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.701 ' OD2' ' HD3' ' A' ' 62' ' ' ARG . 33.4 m-20 -63.01 -41.99 99.7 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.087 -179.198 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 54.1 tp -60.18 -38.49 83.39 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.799 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.31 -15.76 62.42 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.953 0.406 . . . . 0.0 111.404 -179.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 94.4 mt -108.25 -4.32 17.65 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.383 -179.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.643 HD21 HD13 ' A' ' 27' ' ' LEU . 82.7 mt -110.67 134.82 52.11 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.778 0.323 . . . . 0.0 110.95 -179.355 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 32.2 m -106.58 116.9 32.73 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.213 0.53 . . . . 0.0 110.287 174.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.8 mp -124.62 150.49 45.96 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.696 -177.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 16.9 m -130.33 123.21 20.42 Favored Pre-proline 0 C--N 1.319 -0.731 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 175.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.438 ' HB3' ' CD1' ' A' ' 10' ' ' TYR . 36.2 Cg_endo -66.48 164.15 29.74 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.031 1.821 . . . . 0.0 111.601 179.032 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 9' ' ' SER . 91.1 mt -54.59 -40.88 69.27 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.796 172.35 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 22.8 t70 . . . . . 0 C--O 1.248 0.984 0 O-C-N 124.065 0.853 . . . . 0.0 110.843 173.864 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.403 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 22.7 t . . . . . 0 N--CA 1.453 -0.316 0 N-CA-C 110.159 -0.312 . . . . 0.0 110.159 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 53.2 mtt180 -129.52 -176.29 3.85 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 121.033 0.444 . . . . 0.0 110.733 -179.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.437 ' HB2' HD13 ' A' ' 74' ' ' LEU . 16.1 m -124.11 138.77 54.39 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.58 -178.565 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 52.3 m-85 -122.24 133.05 54.71 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.566 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 8.0 ptp180 -100.5 157.62 16.51 Favored 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 119.998 -0.681 . . . . 0.0 110.261 175.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.418 HG12 ' CD2' ' A' ' 71' ' ' LEU . 22.2 mt -100.64 116.35 43.94 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.944 -179.784 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 1.4 m -92.22 -19.75 21.89 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.882 -177.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 164.79 -149.41 16.12 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.424 -179.28 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.448 ' HB3' HG22 ' A' ' 19' ' ' ILE . 72.5 m-85 -121.97 152.63 39.5 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.828 0.347 . . . . 0.0 110.821 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.725 ' O ' HG21 ' A' ' 19' ' ' ILE . 49.4 m -82.24 153.25 68.85 Favored Pre-proline 0 N--CA 1.448 -0.542 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.887 -179.53 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -62.38 -16.26 50.48 Favored 'Trans proline' 0 CA--C 1.532 0.395 0 C-N-CA 122.693 2.262 . . . . 0.0 113.218 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -83.92 -7.18 59.49 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -177.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.725 HG21 ' O ' ' A' ' 16' ' ' SER . 10.4 tt -92.88 147.7 5.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 C-N-CA 120.556 -0.458 . . . . 0.0 110.719 -179.409 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.3 t -84.98 158.1 20.6 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.635 -0.505 . . . . 0.0 109.635 178.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.486 ' O ' ' HB3' ' A' ' 24' ' ' ARG . 26.8 t-20 -63.5 -47.48 81.54 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.649 0.261 . . . . 0.0 111.373 -174.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.73 -38.33 95.48 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.433 -0.889 . . . . 0.0 112.208 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -64.53 -39.89 94.6 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 177.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.486 ' HB3' ' O ' ' A' ' 21' ' ' ASN . 15.9 ttm180 -56.2 -45.22 79.92 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.376 172.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -68.91 -31.57 70.58 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.224 -178.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.46 ' O ' ' HG3' ' A' ' 30' ' ' MET . 4.0 tmm_? -68.71 -39.68 80.32 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 175.509 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.434 HD22 HD12 ' A' ' 32' ' ' LEU . 40.2 mt -68.18 -40.5 82.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.332 0.587 . . . . 0.0 110.317 176.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -55.57 -48.02 75.47 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.079 174.255 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 47.8 m -60.07 -33.89 72.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.15 178.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' MET . . . . . 0.46 ' HG3' ' O ' ' A' ' 26' ' ' ARG . 90.1 mtp -70.47 -27.33 64.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.898 178.649 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.77 8.07 11.22 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.356 -178.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.476 HD11 HD13 ' A' ' 69' ' ' LEU . 76.4 mt -99.69 94.03 6.14 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.009 0.433 . . . . 0.0 110.09 -179.388 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.522 ' HB2' ' HD2' ' A' ' 34' ' ' PRO . 1.7 pt? -140.31 161.83 53.03 Favored Pre-proline 0 N--CA 1.447 -0.596 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.496 -178.588 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.522 ' HD2' ' HB2' ' A' ' 33' ' ' LEU . 18.7 Cg_endo -59.74 128.46 27.01 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.867 2.378 . . . . 0.0 111.77 175.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 111.62 4.05 26.76 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.128 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -113.82 172.83 6.75 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 120.982 0.42 . . . . 0.0 110.132 178.201 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.566 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -152.89 139.66 18.95 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.412 -178.05 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.642 HD12 HG21 ' A' ' 52' ' ' VAL . 50.5 mt -127.16 136.72 52.47 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.193 -178.113 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 16.3 ttm180 -99.67 131.06 45.9 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 174.028 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.55 HG22 HD12 ' A' ' 43' ' ' ILE . 9.0 p -72.55 135.08 28.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.342 0.591 . . . . 0.0 111.695 -172.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 75.4 t -106.54 -47.34 8.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.643 176.331 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.609 ' HB2' ' HB2' ' A' ' 51' ' ' GLN . 79.0 mtt180 -157.64 138.91 13.57 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -172.533 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.55 HD12 HG22 ' A' ' 40' ' ' VAL . 4.5 mp -130.0 119.87 48.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 163.39 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.637 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -67.62 138.19 93.41 Favored Pre-proline 0 C--N 1.322 -0.607 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.125 -176.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -58.88 -19.17 45.99 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 123.618 2.879 . . . . 0.0 112.924 -178.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -55.96 -39.62 72.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.723 0.773 . . . . 0.0 110.727 176.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 162.16 -74.52 0.19 Allowed Glycine 0 CA--C 1.494 -1.23 0 N-CA-C 110.509 -1.036 . . . . 0.0 110.509 -175.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.635 ' OD1' HG13 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -163.23 120.72 1.23 Allowed Pre-proline 0 N--CA 1.436 -1.132 0 N-CA-C 115.543 1.683 . . . . 0.0 115.543 176.897 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.637 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 31.3 Cg_endo -116.33 155.08 0.03 OUTLIER 'Trans proline' 0 N--CA 1.437 -1.798 1 C-N-CA 125.348 4.032 . . . . 0.0 108.439 123.614 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.899 HD13 HD21 ' A' ' 66' ' ' LEU . 96.0 mt -118.45 103.81 15.18 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.721 0 C-N-CA 119.209 -0.997 . . . . 0.0 110.938 -177.535 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.688 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 36.0 mt-30 -92.9 123.31 36.07 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.979 177.199 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.642 HG21 HD12 ' A' ' 38' ' ' LEU . 27.1 m -139.68 170.3 15.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.164 -177.653 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -116.9 135.48 53.69 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.1 m -110.29 -41.24 4.45 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.673 -172.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.7 ttm180 -176.72 -37.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.747 -173.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -120.93 -53.44 2.06 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.879 0.371 . . . . 0.0 110.638 -174.464 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.6 t -142.31 175.07 10.05 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 -174.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.484 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 13.9 m -88.53 134.05 33.98 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-O 121.318 0.58 . . . . 0.0 110.624 -178.725 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.688 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 3.1 mm? -112.02 173.72 6.22 Favored 'General case' 0 C--N 1.317 -0.848 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.178 179.486 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.587 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -142.19 144.4 33.39 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.088 -178.416 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -154.36 -175.34 5.35 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 -178.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.425 ' HA ' ' HD3' ' A' ' 62' ' ' ARG . 19.6 mmt180 -107.42 160.27 15.76 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 122.208 1.004 . . . . 0.0 112.792 -178.445 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -56.0 -41.44 74.87 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 113.008 -1.905 . . . . 0.0 112.094 -179.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.537 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 42.8 tttp -66.97 -43.11 83.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.714 0.292 . . . . 0.0 110.489 -176.152 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -59.71 -40.68 88.75 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.145 177.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.899 HD21 HD13 ' A' ' 50' ' ' ILE . 10.4 tp -70.48 -39.02 74.48 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.632 179.566 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.74 -26.84 66.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.456 -179.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.617 ' HB3' ' HB ' ' A' ' 19' ' ' ILE . 94.6 mt -77.51 -7.65 56.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.983 0.421 . . . . 0.0 110.564 177.564 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.476 HD13 HD11 ' A' ' 32' ' ' LEU . 68.5 mt -99.02 140.91 32.47 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.662 174.342 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 28.7 m -85.74 114.05 22.4 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 172.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.554 HD12 ' HG ' ' A' ' 66' ' ' LEU . 68.9 mt -120.3 139.12 53.2 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.626 -174.332 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.425 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 28.5 m -127.0 129.52 23.97 Favored Pre-proline 0 C--N 1.318 -0.799 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.496 170.054 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 72' ' ' VAL . 3.3 Cg_exo -75.65 162.43 35.46 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 122.108 1.872 . . . . 0.0 111.736 -179.289 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.437 HD13 ' HB2' ' A' ' 9' ' ' SER . 60.7 mt -69.78 -34.62 74.01 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.204 172.55 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 37.1 t70 . . . . . 0 C--O 1.25 1.121 0 CA-C-O 118.611 -0.709 . . . . 0.0 109.834 177.906 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 48.0 t . . . . . 0 N--CA 1.452 -0.337 0 CA-C-O 120.641 0.258 . . . . 0.0 111.104 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 42.2 mtp85 -115.45 152.85 32.17 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.12 0.486 . . . . 0.0 111.475 -175.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.434 ' HB2' HD12 ' A' ' 74' ' ' LEU . 7.8 m -117.12 143.87 45.32 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.062 177.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 93.9 m-85 -128.89 140.03 51.87 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.813 0.339 . . . . 0.0 110.863 -175.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.53 ' HD3' ' HB3' ' A' ' 37' ' ' ALA . 28.7 mmt180 -83.75 150.91 25.51 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.829 175.21 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.583 HG12 ' CD2' ' A' ' 71' ' ' LEU . 46.0 mt -103.06 113.07 38.76 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 169.425 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 6.7 p -90.32 -11.68 40.01 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.06 0.457 . . . . 0.0 111.092 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 161.2 -158.33 30.0 Favored Glycine 0 N--CA 1.442 -0.955 0 C-N-CA 120.293 -0.956 . . . . 0.0 112.175 177.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 48.2 m-85 -114.99 150.17 36.23 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 -179.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 53.0 m -72.22 137.89 81.56 Favored Pre-proline 0 C--N 1.316 -0.884 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.424 -179.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -52.88 156.3 9.63 Favored 'Trans proline' 0 C--O 1.237 0.474 0 C-N-CA 122.941 2.427 . . . . 0.0 112.548 178.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 75.01 12.9 3.39 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.289 -177.143 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 16.0 tt -83.94 146.71 6.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.192 176.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.9 t -74.44 140.31 44.56 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 178.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -62.06 -49.83 74.4 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.917 -177.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.45 -31.27 80.32 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.976 -0.631 . . . . 0.0 112.359 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.433 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 21.5 t80 -72.59 -37.46 68.14 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.433 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.8 ttm180 -59.14 -43.0 91.99 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.759 172.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -66.04 -39.18 89.94 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.386 177.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 26' ' ' ARG . 5.1 tpt180 -63.44 -39.31 94.14 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.019 178.268 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 23' ' ' TYR . 95.5 mt -66.58 -45.01 80.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.805 177.411 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -55.89 -47.77 76.82 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.3 176.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 50.3 m -60.93 -35.31 76.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.135 179.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 71.9 mtm -78.96 -14.98 58.89 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.75 -178.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 114.28 6.21 20.41 Favored Glycine 0 N--CA 1.453 -0.209 0 C-N-CA 120.331 -0.938 . . . . 0.0 113.026 175.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.648 HD13 HD11 ' A' ' 69' ' ' LEU . 82.6 mt -99.87 87.04 3.41 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 178.634 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.42 ' HB2' ' HD2' ' A' ' 34' ' ' PRO . 1.8 pt? -129.99 157.64 76.33 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.757 -177.186 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.42 ' HD2' ' HB2' ' A' ' 33' ' ' LEU . 18.0 Cg_endo -61.06 123.75 13.51 Favored 'Trans proline' 0 C--O 1.235 0.341 0 C-N-CA 122.534 2.156 . . . . 0.0 111.577 177.05 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 111.9 -17.43 24.98 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 121.04 -0.6 . . . . 0.0 111.856 -176.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -91.84 111.44 22.97 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.068 0.461 . . . . 0.0 110.234 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.53 ' HB3' ' HD3' ' A' ' 11' ' ' ARG . . . -90.37 129.06 36.62 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.828 177.353 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.41 HD21 ' N ' ' A' ' 38' ' ' LEU . 2.8 mm? -104.31 143.54 32.84 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.561 178.367 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' ' 39' ' ' ARG . 36.1 ttm180 -105.21 124.62 49.85 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.339 176.482 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 5.8 p -66.87 125.88 25.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.18 0.515 . . . . 0.0 110.377 -178.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 21.2 t -104.97 -39.46 5.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.543 -178.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 19.6 ttm180 -158.1 121.71 4.01 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 121.095 -0.242 . . . . 0.0 110.887 179.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.445 ' HA ' HG21 ' A' ' 50' ' ' ILE . 4.2 mp -97.42 130.37 46.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 178.514 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.448 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -75.58 134.69 72.5 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 174.824 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 24.7 Cg_exo -64.16 -4.34 7.58 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 123.113 2.542 . . . . 0.0 113.425 -174.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 7.0 mp -93.36 -20.83 19.97 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.663 0.268 . . . . 0.0 111.113 -179.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.62 -16.93 60.25 Favored Glycine 0 N--CA 1.453 -0.231 0 N-CA-C 110.774 -0.93 . . . . 0.0 110.774 -172.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.772 ' HB3' ' HD2' ' A' ' 49' ' ' PRO . 0.4 OUTLIER -69.43 170.05 10.39 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 114.72 -0.74 . . . . 0.0 109.594 171.726 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.8 ' HD3' ' HD3' ' A' ' 62' ' ' ARG . 5.6 Cg_exo -32.37 150.0 0.02 OUTLIER 'Trans proline' 0 C--N 1.361 1.209 0 C-N-CA 124.849 3.699 . . . . 0.0 116.718 -155.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.445 HG21 ' HA ' ' A' ' 43' ' ' ILE . 69.1 mt -124.07 134.22 67.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-N 113.684 -1.598 . . . . 0.0 109.634 -173.642 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.438 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 2.3 mp0 -78.76 120.69 23.76 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 177.686 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.442 ' O ' ' HA ' ' A' ' 58' ' ' SER . 27.3 m -128.4 160.01 39.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.666 -178.009 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -112.37 130.82 55.83 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.715 -173.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.5 t -104.09 -34.44 8.41 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.979 176.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 34.1 mtp180 -153.34 -89.35 0.05 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.526 177.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -112.89 0.79 15.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.484 -178.084 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.5 t -133.0 154.7 50.27 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.878 -177.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.442 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 7.2 m -104.92 139.21 39.97 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.663 -178.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.438 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 7.4 mp -118.0 173.23 6.89 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.942 178.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -142.52 141.78 32.13 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.667 0.27 . . . . 0.0 110.766 -179.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.565 ' O ' ' HA ' ' A' ' 49' ' ' PRO . 3.3 pp -143.97 150.99 39.16 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 178.638 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.8 ' HD3' ' HD3' ' A' ' 49' ' ' PRO . 32.1 mmt180 -73.77 174.16 8.82 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 121.382 0.611 . . . . 0.0 111.173 -176.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 16.9 ptt180 -70.35 -33.7 71.77 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.895 179.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.439 ' HD2' ' C ' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -57.41 -47.4 81.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.074 174.14 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -68.28 -37.7 80.93 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.955 -177.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 38.8 tp -59.31 -38.94 81.54 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.842 177.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.93 -25.63 63.75 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.153 -178.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 82.0 mt -83.91 -8.6 59.14 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.23 -177.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.648 HD11 HD13 ' A' ' 32' ' ' LEU . 96.9 mt -103.86 132.7 49.86 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 110.251 -0.277 . . . . 0.0 110.251 178.036 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.0 m -89.43 114.18 25.62 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 175.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.583 ' CD2' HG12 ' A' ' 12' ' ' ILE . 73.6 mt -118.71 132.21 56.15 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.001 -173.391 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 27.2 m -122.06 132.77 24.19 Favored Pre-proline 0 C--N 1.318 -0.804 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.625 173.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -69.45 163.41 38.11 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 121.84 1.693 . . . . 0.0 112.426 -176.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.434 HD12 ' HB2' ' A' ' 9' ' ' SER . 85.9 mt -67.04 -14.97 63.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.732 173.116 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.6 t0 . . . . . 0 C--O 1.252 1.204 0 O-C-N 124.165 0.916 . . . . 0.0 110.318 -178.231 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.9 t . . . . . 0 N--CA 1.45 -0.468 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 -155.79 144.77 20.58 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 176.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.483 ' HB2' HD12 ' A' ' 74' ' ' LEU . 15.1 m -90.94 140.7 29.58 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 -179.598 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -124.27 142.22 51.43 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.843 0.354 . . . . 0.0 110.7 -175.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.558 ' HG3' HD21 ' A' ' 74' ' ' LEU . 90.6 mtt-85 -99.05 157.25 16.47 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.717 175.422 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 49.7 mt -94.07 112.99 27.85 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.739 179.006 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.96 -33.35 70.38 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.434 0.635 . . . . 0.0 110.156 178.154 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.549 ' HA2' ' HB3' ' A' ' 34' ' ' PRO . . . 153.94 -147.36 16.59 Favored Glycine 0 N--CA 1.444 -0.807 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.329 -179.655 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -113.61 160.56 18.43 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 -179.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.43 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 34.0 t -62.8 133.01 94.96 Favored Pre-proline 0 C--N 1.321 -0.665 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 172.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 31.7 Cg_exo -60.1 -16.53 40.2 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.895 2.396 . . . . 0.0 112.727 -178.683 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -103.6 24.33 11.3 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.081 -178.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 18.4 tt -71.2 155.01 7.67 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 175.564 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.1 p -124.24 127.15 47.26 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -172.113 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.486 ' HB3' ' H ' ' A' ' 22' ' ' GLY . 16.7 m120 64.94 -156.32 0.29 Allowed 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.222 -0.899 . . . . 0.0 112.478 168.615 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.486 ' H ' ' HB3' ' A' ' 21' ' ' ASN . . . -75.14 15.09 4.39 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 115.337 -0.847 . . . . 0.0 113.356 -175.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 29.1 t80 -61.95 -36.09 80.38 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 174.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 4.4 tmm_? -64.62 -39.77 94.29 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.373 175.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -68.58 -35.31 77.2 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.246 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.402 ' O ' ' HG3' ' A' ' 30' ' ' MET . 62.8 ttt180 -64.4 -41.44 96.64 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.691 176.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.801 HD11 HD23 ' A' ' 69' ' ' LEU . 83.7 mt -67.17 -43.66 81.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.186 177.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -59.5 -44.58 93.05 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.502 178.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.3 m -64.24 -33.77 76.58 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.886 179.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' MET . . . . . 0.402 ' HG3' ' O ' ' A' ' 26' ' ' ARG . 70.4 mtm -78.12 -16.47 57.93 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.327 -178.163 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 112.78 11.87 13.7 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.427 -0.892 . . . . 0.0 113.013 174.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 94.4 mt -100.63 95.9 7.0 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.794 0.331 . . . . 0.0 110.321 179.447 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -132.52 152.81 80.66 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.686 -179.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.549 ' HB3' ' HA2' ' A' ' 14' ' ' GLY . 24.0 Cg_endo -62.4 139.14 75.22 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.855 2.37 . . . . 0.0 112.132 179.11 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 107.36 -26.33 18.84 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.298 178.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.07 -172.47 4.15 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 121.141 0.496 . . . . 0.0 110.212 -178.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.549 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -145.28 144.06 30.55 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.066 -176.606 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.414 HD13 HG22 ' A' ' 52' ' ' VAL . 84.1 mt -118.47 137.82 52.92 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.687 178.013 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 40.2 ttt85 -101.71 117.62 35.25 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.522 ' HA ' HG11 ' A' ' 52' ' ' VAL . 14.5 p -62.48 127.1 21.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.66 0.743 . . . . 0.0 111.707 -176.253 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 91.6 t -90.4 -61.26 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.969 170.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 50.1 mtp180 -167.13 155.43 9.69 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 123.72 0.638 . . . . 0.0 111.597 -177.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.461 HG23 ' HD2' ' A' ' 49' ' ' PRO . 3.3 mp -117.15 116.7 52.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 163.565 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -54.13 135.02 59.29 Favored Pre-proline 0 C--N 1.326 -0.416 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -67.86 -1.58 7.12 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.812 2.341 . . . . 0.0 112.141 179.133 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.409 HD11 ' HA ' ' A' ' 46' ' ' LEU . 3.9 mm? -63.8 -28.8 70.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.577 174.268 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 157.46 -76.59 0.2 Allowed Glycine 0 N--CA 1.438 -1.181 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.939 -176.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -167.78 120.01 0.72 Allowed Pre-proline 0 N--CA 1.448 -0.543 0 N-CA-C 113.882 1.067 . . . . 0.0 113.882 176.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.461 ' HD2' HG23 ' A' ' 43' ' ' ILE . 81.1 Cg_endo -118.67 -168.72 0.02 OUTLIER 'Trans proline' 0 N--CA 1.433 -2.055 1 C-N-CA 126.372 4.715 . . . . 0.0 108.243 140.318 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.73 HD11 HD13 ' A' ' 61' ' ' LEU . 62.6 mt -140.67 100.62 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 168.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.411 ' OE1' ' HB1' ' A' ' 60' ' ' ALA . 5.3 tp60 -86.93 116.52 25.04 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 178.478 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.522 HG11 ' HA ' ' A' ' 40' ' ' VAL . 11.5 m -136.79 175.97 8.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.528 0.204 . . . . 0.0 110.56 -177.851 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.409 ' HG2' ' N ' ' A' ' 55' ' ' ARG . 40.8 tt0 -147.17 138.88 24.19 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 176.065 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -86.16 27.23 0.93 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.093 0.473 . . . . 0.0 109.912 176.745 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.409 ' N ' ' HG2' ' A' ' 53' ' ' GLU . 43.3 ttm105 67.1 16.01 10.19 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 121.904 0.859 . . . . 0.0 109.923 -175.833 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -139.42 -70.55 0.4 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.382 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 17.0 m -114.61 141.65 47.5 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.046 177.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 23.1 p -85.32 146.98 26.76 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.954 0.407 . . . . 0.0 110.491 176.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 15.9 mt -141.19 167.35 22.38 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.639 -179.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.491 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -137.93 154.77 49.38 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 114.678 -1.146 . . . . 0.0 109.873 -179.385 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.73 HD13 HD11 ' A' ' 50' ' ' ILE . 1.3 pp -157.31 168.3 27.78 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 -179.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.64 ' HD3' ' OD2' ' A' ' 65' ' ' ASP . 0.1 OUTLIER -107.63 172.49 6.8 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.042 0.449 . . . . 0.0 110.329 -176.899 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.506 ' HG3' ' N ' ' A' ' 64' ' ' LYS . 0.2 OUTLIER -59.97 -34.03 72.74 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.549 174.258 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.506 ' N ' ' HG3' ' A' ' 63' ' ' ARG . 1.5 tmtp? -62.5 -40.91 98.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.969 -1.014 . . . . 0.0 110.297 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.64 ' OD2' ' HD3' ' A' ' 62' ' ' ARG . 26.1 m-20 -72.94 -37.86 66.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.797 179.168 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 53.0 tp -61.27 -31.63 71.45 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.481 177.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.11 -10.9 60.41 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.302 178.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 95.9 mt -110.59 -5.29 15.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.962 0.411 . . . . 0.0 110.815 179.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.801 HD23 HD11 ' A' ' 27' ' ' LEU . 98.7 mt -123.53 125.29 44.62 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.623 -177.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 6.7 m -91.53 114.25 26.73 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.009 0.433 . . . . 0.0 110.065 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 8.9 mp -125.65 143.61 50.96 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.466 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 15.6 m -137.23 159.15 70.82 Favored Pre-proline 0 C--N 1.32 -0.697 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.643 178.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -61.29 167.64 9.09 Favored 'Trans proline' 0 C--O 1.234 0.284 0 C-N-CA 122.206 1.938 . . . . 0.0 112.068 177.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.558 HD21 ' HG3' ' A' ' 11' ' ' ARG . 86.3 mt -54.42 -56.25 20.57 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.985 0.421 . . . . 0.0 110.383 176.441 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.6 t0 . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.259 -0.876 . . . . 0.0 109.287 177.858 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 38.5 t . . . . . 0 N--CA 1.449 -0.493 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 87.9 mtt180 -133.68 179.67 6.09 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 121.384 0.612 . . . . 0.0 110.884 -179.08 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 37.3 m -124.59 129.64 50.95 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.085 176.211 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -113.99 149.18 35.72 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.917 0.389 . . . . 0.0 110.87 -174.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 78.7 mtp180 -105.46 153.24 21.98 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 174.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.648 HD11 ' HB3' ' A' ' 36' ' ' ALA . 35.2 mt -97.2 105.58 17.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 177.354 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.417 ' HG1' HG12 ' A' ' 72' ' ' VAL . 0.2 OUTLIER -67.66 -31.45 71.46 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.4 0.619 . . . . 0.0 110.188 179.059 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 160.09 -153.49 24.46 Favored Glycine 0 N--CA 1.443 -0.89 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.311 -178.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 66.2 m-85 -99.38 162.39 13.07 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 179.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.7 t -69.63 132.67 89.05 Favored Pre-proline 0 C--N 1.317 -0.845 0 N-CA-C 109.103 -0.702 . . . . 0.0 109.103 172.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -63.33 -7.07 11.29 Favored 'Trans proline' 0 C--O 1.233 0.255 0 C-N-CA 122.595 2.197 . . . . 0.0 112.67 -178.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.37 1.71 56.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.287 178.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 14.7 tt -75.12 146.75 9.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 179.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.7 t -160.37 -178.95 7.28 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 121.166 -0.214 . . . . 0.0 110.451 -177.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.4 t30 70.78 7.4 6.2 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 123.731 0.812 . . . . 0.0 111.767 175.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.7 14.13 61.79 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.542 -0.837 . . . . 0.0 113.051 177.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -65.28 -24.16 67.23 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.002 0.429 . . . . 0.0 110.085 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 24' ' ' ARG . 25.8 ttt180 -53.1 -48.66 67.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.578 173.566 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -64.98 -28.17 69.33 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.353 -179.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 26.5 tpt180 -74.33 -40.96 61.84 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.852 176.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.689 HD23 HD13 ' A' ' 32' ' ' LEU . 46.1 mt -66.91 -42.1 86.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.755 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -59.72 -43.15 94.29 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.923 177.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 70.1 m -63.15 -30.69 71.79 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.323 177.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 89.3 mtp -80.23 -16.18 55.34 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.218 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 108.98 10.82 23.76 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.479 -0.867 . . . . 0.0 112.647 176.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.883 HD12 HD12 ' A' ' 69' ' ' LEU . 84.8 mt -101.42 100.11 10.54 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.961 0.41 . . . . 0.0 109.925 179.374 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -131.8 156.12 80.52 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.817 -177.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -64.69 125.44 14.88 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.719 2.28 . . . . 0.0 111.473 176.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 109.55 -1.07 30.73 Favored Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.652 -0.785 . . . . 0.0 112.838 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.648 ' HB3' HD11 ' A' ' 12' ' ' ILE . . . -88.4 -172.75 3.9 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 120.989 0.423 . . . . 0.0 110.046 178.807 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -158.13 146.88 19.09 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.455 -177.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.413 HD12 HG21 ' A' ' 52' ' ' VAL . 82.5 mt -137.74 139.85 40.35 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.925 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 52.5 ttm-85 -101.72 124.85 48.05 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 175.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.559 ' HA ' HG13 ' A' ' 52' ' ' VAL . 9.3 p -75.88 122.69 30.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.522 0.677 . . . . 0.0 110.622 -177.239 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.584 HG13 ' HG3' ' A' ' 42' ' ' ARG . 48.9 t -93.73 -52.9 9.13 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.36 178.279 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.584 ' HG3' HG13 ' A' ' 41' ' ' VAL . 96.5 mtt180 -152.74 140.39 19.86 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -174.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.459 HD11 HG21 ' A' ' 40' ' ' VAL . 4.5 mp -116.27 144.22 24.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 164.783 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.539 ' H ' ' CD ' ' A' ' 49' ' ' PRO . . . -81.94 138.36 46.42 Favored Pre-proline 0 C--N 1.318 -0.785 0 CA-C-N 117.788 0.267 . . . . 0.0 110.923 178.645 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -66.14 -5.31 12.07 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 123.24 2.626 . . . . 0.0 112.56 179.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -65.53 -35.89 82.2 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.206 174.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 158.65 -77.49 0.19 Allowed Glycine 0 N--CA 1.438 -1.226 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.037 -176.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -153.62 120.03 2.88 Favored Pre-proline 0 N--CA 1.445 -0.724 0 N-CA-C 114.501 1.297 . . . . 0.0 114.501 179.302 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.539 ' CD ' ' H ' ' A' ' 44' ' ' ALA . 94.6 Cg_endo -119.51 -173.51 0.02 OUTLIER 'Trans proline' 0 N--CA 1.436 -1.854 1 C-N-CA 126.482 4.788 . . . . 0.0 107.693 131.301 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.687 HG22 HG12 ' A' ' 52' ' ' VAL . 57.1 mt -142.1 100.85 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.425 0 C-N-CA 119.749 -0.78 . . . . 0.0 109.942 170.81 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.55 HE22 ' HB3' ' A' ' 58' ' ' SER . 0.0 OUTLIER -87.57 112.57 22.41 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 178.437 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.687 HG12 HG22 ' A' ' 50' ' ' ILE . 24.2 m -129.41 -177.12 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.831 0.348 . . . . 0.0 110.59 -177.058 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -133.74 132.1 40.18 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 174.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.4 m -76.79 -30.98 56.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.082 0.467 . . . . 0.0 110.931 -176.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.3 ptp180 173.72 -26.26 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.642 -178.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -155.25 -36.73 0.09 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.166 -179.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.7 t -96.88 141.73 29.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.416 -179.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.55 ' HB3' HE22 ' A' ' 51' ' ' GLN . 45.4 m -80.95 146.59 30.67 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.618 178.445 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.8 tp -138.62 159.92 40.9 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.296 -179.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.561 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -138.94 156.84 46.93 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.927 -0.398 . . . . 0.0 109.927 177.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.666 HD12 HD11 ' A' ' 50' ' ' ILE . 3.7 pp -161.94 168.8 22.28 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -178.119 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.638 ' HD3' ' OD2' ' A' ' 65' ' ' ASP . 0.0 OUTLIER -109.43 169.04 8.95 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.448 0.642 . . . . 0.0 111.293 -177.603 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.563 ' HD2' ' N ' ' A' ' 64' ' ' LYS . 2.0 ppt_? -58.35 -33.25 69.35 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.69 -1.141 . . . . 0.0 111.796 176.223 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.563 ' N ' ' HD2' ' A' ' 63' ' ' ARG . 88.6 tttt -63.96 -44.61 92.27 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.489 176.406 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.638 ' OD2' ' HD3' ' A' ' 62' ' ' ARG . 23.3 m-20 -65.94 -36.8 84.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.287 0.565 . . . . 0.0 109.596 177.757 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.3 tp -59.25 -35.68 74.12 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.621 175.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.87 -10.48 58.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.622 -178.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 78.5 mt -94.84 -13.85 25.15 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.958 0.409 . . . . 0.0 110.444 178.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.883 HD12 HD12 ' A' ' 32' ' ' LEU . 96.7 mt -115.03 150.08 36.44 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.071 0.462 . . . . 0.0 110.865 -177.615 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 22.6 m -108.51 118.89 37.95 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.368 -0.605 . . . . 0.0 109.368 170.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 77.9 mt -120.02 138.41 53.53 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.99 -174.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.427 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 19.7 m -130.73 134.42 25.99 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.659 174.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 72' ' ' VAL . 27.7 Cg_exo -62.07 164.59 16.55 Favored 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 122.283 1.989 . . . . 0.0 112.103 179.499 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 96.0 mt -53.25 -42.1 66.13 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.538 175.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 33.9 t70 . . . . . 0 C--O 1.247 0.962 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.77 177.607 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 29.7 t . . . . . 0 N--CA 1.453 -0.302 0 CA-C-O 120.45 0.167 . . . . 0.0 111.176 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.402 ' HD2' ' HA ' ' A' ' 8' ' ' ARG . 0.5 OUTLIER -93.66 164.88 12.98 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.99 0.424 . . . . 0.0 110.487 -177.057 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.445 ' OG ' ' HG3' ' A' ' 39' ' ' ARG . 16.6 m -132.51 139.18 47.81 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.886 178.386 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -120.4 133.44 55.43 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.116 -177.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.647 HH11 ' HB3' ' A' ' 37' ' ' ALA . 21.8 mmm180 -89.21 148.52 23.57 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 178.33 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.526 HG12 ' CD2' ' A' ' 71' ' ' LEU . 47.7 mt -102.42 113.06 37.87 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 175.364 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 4.5 p -81.21 -23.37 38.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.859 0.361 . . . . 0.0 110.904 179.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 161.75 -145.89 11.43 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 120.457 -0.878 . . . . 0.0 112.102 -178.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -117.99 154.55 31.78 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.161 0.505 . . . . 0.0 110.889 -175.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.437 ' O ' HG21 ' A' ' 19' ' ' ILE . 43.3 t -73.64 139.99 78.05 Favored Pre-proline 0 C--N 1.318 -0.782 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.319 174.148 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 31.3 Cg_exo -60.5 -8.73 9.43 Favored 'Trans proline' 0 N--CA 1.475 0.398 0 C-N-CA 123.152 2.568 . . . . 0.0 113.341 -178.814 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.63 -6.36 58.93 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.515 179.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.437 HG21 ' O ' ' A' ' 16' ' ' SER . 16.5 tt -79.23 139.47 18.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-O 120.909 0.385 . . . . 0.0 110.006 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.8 p -153.41 170.97 19.4 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -176.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 67.62 38.01 3.17 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.578 172.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.94 21.04 75.12 Favored Glycine 0 N--CA 1.454 -0.136 0 C-N-CA 121.027 -0.606 . . . . 0.0 113.594 174.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.404 ' HB3' ' CG1' ' A' ' 19' ' ' ILE . 7.3 t80 -66.83 -22.83 65.99 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.829 0.347 . . . . 0.0 110.446 -177.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 32.1 mtp180 -64.52 -40.89 96.45 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.663 175.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -69.12 -35.52 76.5 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 120.989 0.423 . . . . 0.0 110.141 179.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -66.06 -42.18 89.78 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.872 177.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.532 HD21 HD11 ' A' ' 32' ' ' LEU . 61.2 mt -70.97 -34.95 71.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.537 -179.785 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -58.46 -44.32 89.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.35 176.405 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 49.3 m -61.44 -35.34 77.31 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.806 178.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 91.9 mtp -75.79 -36.34 59.78 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.51 -178.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.04 14.97 5.34 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.202 -178.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.532 HD11 HD21 ' A' ' 27' ' ' LEU . 94.5 mt -104.46 91.98 4.12 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.911 0.386 . . . . 0.0 110.25 179.375 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.495 ' HB2' ' HD2' ' A' ' 34' ' ' PRO . 1.7 pt? -137.83 160.54 64.35 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.392 -179.224 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.495 ' HD2' ' HB2' ' A' ' 33' ' ' LEU . 13.8 Cg_endo -57.44 129.99 36.78 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.797 2.331 . . . . 0.0 111.659 176.716 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 110.75 -17.27 27.93 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.227 -177.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.66 100.55 12.9 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.913 0.387 . . . . 0.0 110.714 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.647 ' HB3' HH11 ' A' ' 11' ' ' ARG . . . -75.8 134.55 40.37 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.906 177.421 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 34.7 mt -110.21 135.91 50.25 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.567 -178.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.538 ' HB2' ' HB3' ' A' ' 53' ' ' GLU . 0.3 OUTLIER -94.55 147.44 23.27 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 172.928 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 11.8 p -85.15 124.11 39.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-O 120.831 0.348 . . . . 0.0 111.036 -176.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 96.0 t -102.63 -50.19 9.93 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 C-N-CA 120.776 -0.37 . . . . 0.0 110.678 173.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.1 ttm180 -177.12 158.04 1.46 Allowed 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -175.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 46.7 mm -129.85 141.7 45.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 170.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.542 ' HB1' ' CD ' ' A' ' 49' ' ' PRO . . . -65.63 152.54 92.51 Favored Pre-proline 0 N--CA 1.469 0.522 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -179.49 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -69.07 -32.1 22.17 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 122.728 2.285 . . . . 0.0 112.616 175.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.416 HD13 ' HA ' ' A' ' 46' ' ' LEU . 4.0 mm? -65.51 -88.58 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.809 0.814 . . . . 0.0 110.45 177.095 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.538 ' O ' ' HB3' ' A' ' 48' ' ' ASP . . . -115.08 -79.27 0.82 Allowed Glycine 0 N--CA 1.432 -1.602 0 N-CA-C 109.119 -1.592 . . . . 0.0 109.119 169.305 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.558 ' OD1' ' HD3' ' A' ' 63' ' ' ARG . 6.0 p-10 166.98 133.3 0.04 OUTLIER Pre-proline 0 N--CA 1.451 -0.423 0 N-CA-C 113.925 1.083 . . . . 0.0 113.925 -178.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.542 ' CD ' ' HB1' ' A' ' 44' ' ' ALA . 7.5 Cg_endo -96.65 152.09 1.17 Allowed 'Trans proline' 0 N--CA 1.432 -2.134 0 N-CA-C 106.828 -2.028 . . . . 0.0 106.828 132.501 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.718 HD12 HD21 ' A' ' 66' ' ' LEU . 62.1 mt -106.23 100.69 11.15 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.695 0 C-N-CA 119.566 -0.853 . . . . 0.0 110.092 -173.802 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -82.4 117.0 22.13 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.711 178.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.506 HG11 HG23 ' A' ' 50' ' ' ILE . 31.1 m -137.4 172.51 14.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.04 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.538 ' HB3' ' HB2' ' A' ' 39' ' ' ARG . 42.9 tt0 -123.18 123.02 39.85 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 176.121 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.7 p -85.14 -30.79 23.7 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.795 -173.091 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 46.8 ttp180 -174.17 -46.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.861 0.362 . . . . 0.0 110.862 179.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 21.9 mt-30 -134.37 -27.13 1.39 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.747 -175.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.8 t -125.8 160.64 29.3 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.852 0.358 . . . . 0.0 111.016 -176.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.3 m -86.08 142.93 28.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.276 177.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 10.3 tt -137.96 145.24 41.75 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.086 -178.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.528 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -121.74 143.51 49.33 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.414 179.054 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.2 pp -150.87 176.55 10.98 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 -178.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -96.42 156.15 16.46 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.477 0.655 . . . . 0.0 111.704 -177.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.558 ' HD3' ' OD1' ' A' ' 48' ' ' ASP . 28.0 ptt-85 -65.11 -33.61 76.43 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.664 179.266 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -55.43 -43.95 75.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.28 176.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -68.47 -39.46 81.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.555 177.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.908 HD13 HD13 ' A' ' 71' ' ' LEU . 18.6 tp -65.45 -29.04 69.67 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.987 -179.541 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.65 -15.91 63.67 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.84 178.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 93.5 mt -96.92 -3.72 41.31 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.697 178.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.2 mt -110.3 130.0 55.63 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.133 178.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 31.4 m -92.1 116.41 28.91 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.348 0.594 . . . . 0.0 110.416 177.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.908 HD13 HD13 ' A' ' 66' ' ' LEU . 77.2 mt -108.57 144.77 35.82 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.102 -176.449 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.401 HG23 ' HB2' ' A' ' 11' ' ' ARG . 15.9 m -132.33 119.23 16.37 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.505 170.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -63.5 163.15 24.9 Favored 'Trans proline' 0 C--O 1.237 0.473 0 C-N-CA 122.209 1.939 . . . . 0.0 112.293 -178.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.409 ' CD1' ' HB2' ' A' ' 9' ' ' SER . 61.0 mt -65.68 -30.4 71.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.335 173.325 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 . . . . . 0 C--O 1.251 1.132 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.779 178.443 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.5 m . . . . . 0 N--CA 1.44 -0.964 0 CA-C-O 121.002 0.43 . . . . 0.0 110.446 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.6 mtt180 -155.18 157.13 36.91 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.499 -178.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.522 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 39.1 m -122.57 130.27 52.83 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.837 -1.074 . . . . 0.0 108.513 170.118 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -110.5 142.03 42.83 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.373 -177.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 12.9 ptt180 -108.05 148.67 29.45 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.303 0.573 . . . . 0.0 110.493 177.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.551 HG12 ' CD2' ' A' ' 71' ' ' LEU . 22.4 mt -90.2 113.34 26.12 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.618 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 10.5 t -91.13 -11.04 39.72 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.744 -0.382 . . . . 0.0 111.143 -178.062 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.652 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 161.36 -168.47 36.6 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.343 -0.932 . . . . 0.0 112.211 177.295 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -98.54 157.06 16.47 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 177.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.4 t -59.24 140.16 87.9 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.642 175.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -65.17 -14.57 45.85 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.271 1.981 . . . . 0.0 111.596 175.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -102.69 12.66 36.0 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.14 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.483 HG13 HD23 ' A' ' 68' ' ' LEU . 12.3 tt -76.27 146.24 9.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.126 0.489 . . . . 0.0 111.006 -177.556 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.572 ' HB2' ' HD2' ' A' ' 23' ' ' TYR . 20.4 m -84.03 145.61 28.4 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.861 175.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -57.25 -43.08 82.66 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.021 0.378 . . . . 0.0 112.021 -175.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -67.51 -35.83 87.4 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.24 -179.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.572 ' HD2' ' HB2' ' A' ' 20' ' ' SER . 19.2 m-85 -67.49 -35.3 78.88 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 122.847 -0.208 . . . . 0.0 110.776 177.688 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 74.2 ttt-85 -62.55 -40.25 96.24 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 174.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -66.59 -40.67 88.99 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.704 177.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 52.9 ttt180 -61.29 -45.46 94.4 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.345 176.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 23' ' ' TYR . 66.9 mt -65.95 -42.84 89.48 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.604 -178.139 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -60.83 -43.32 98.42 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.949 178.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 59.2 m -66.78 -29.59 69.57 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.381 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 84.2 mtp -77.91 -18.11 56.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.037 177.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 103.38 15.01 24.42 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.374 178.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.567 HD13 HD12 ' A' ' 69' ' ' LEU . 92.3 mt -100.93 97.94 8.47 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.008 0.432 . . . . 0.0 110.117 -179.52 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -132.9 159.2 73.56 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.133 -177.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.652 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 37.1 Cg_exo -60.47 128.58 26.48 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.653 2.236 . . . . 0.0 111.455 176.361 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 115.37 -12.73 18.92 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 120.668 -0.777 . . . . 0.0 111.891 -176.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.496 ' HB3' HD13 ' A' ' 12' ' ' ILE . . . -89.41 176.47 6.9 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-O 121.329 0.585 . . . . 0.0 110.09 179.156 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -147.19 150.65 35.32 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.134 -177.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 55.3 mt -127.53 131.34 50.07 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.66 177.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -107.67 127.69 53.89 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.704 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 14.7 p -62.17 124.72 17.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.174 0.511 . . . . 0.0 111.592 -176.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 85.1 t -97.26 -52.92 8.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.696 173.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 38.6 mtp-105 -151.54 157.01 41.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.137 179.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.461 HG12 HG21 ' A' ' 50' ' ' ILE . 64.9 mt -127.65 131.87 69.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 176.252 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.433 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -65.13 141.41 98.28 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.384 178.565 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 32.0 Cg_exo -59.24 -16.0 31.9 Favored 'Trans proline' 0 N--CA 1.476 0.48 0 C-N-CA 123.259 2.639 . . . . 0.0 113.65 -174.588 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.414 HD22 ' N ' ' A' ' 46' ' ' LEU . 2.2 mm? -89.12 -16.98 30.16 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.702 0.287 . . . . 0.0 111.202 -177.563 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.72 -16.86 60.39 Favored Glycine 0 N--CA 1.454 -0.125 0 N-CA-C 111.016 -0.833 . . . . 0.0 111.016 -174.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.94 ' HB3' ' HD2' ' A' ' 49' ' ' PRO . 1.5 m-20 -65.62 170.6 4.56 Favored Pre-proline 0 C--N 1.326 -0.448 0 C-N-CA 123.601 0.761 . . . . 0.0 110.616 173.346 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.94 ' HD2' ' HB3' ' A' ' 48' ' ' ASP . 23.3 Cg_exo -19.77 151.38 0.0 OUTLIER 'Trans proline' 0 C--N 1.366 1.459 1 C-N-CA 126.675 4.917 . . . . 0.0 117.434 -163.693 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.486 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 62.3 mt -123.6 138.8 52.18 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 CA-C-N 113.862 -1.517 . . . . 0.0 110.604 -166.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 27.8 mp0 -86.04 119.35 26.25 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 175.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 28.3 m -130.83 159.11 43.11 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.824 -176.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -116.41 141.83 47.66 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 -178.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.434 ' O ' ' HB2' ' A' ' 55' ' ' ARG . 35.4 p -97.69 -45.15 6.48 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.356 0.598 . . . . 0.0 109.879 179.438 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.434 ' HB2' ' O ' ' A' ' 54' ' ' THR . 0.0 OUTLIER 167.66 -46.46 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 114.508 -1.224 . . . . 0.0 107.971 -173.238 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.53 -54.91 2.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.0 -175.706 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.9 t -126.86 144.34 51.01 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.041 -172.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 9.9 m -91.62 139.27 30.86 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.643 -178.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.7 mp -121.14 168.91 11.06 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.789 -178.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.486 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -142.18 124.9 15.93 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.321 175.019 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.538 ' HB2' ' HB2' ' A' ' 65' ' ' ASP . 3.5 pp -126.56 146.66 50.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.642 -173.119 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.7 ' HG3' ' HG3' ' A' ' 49' ' ' PRO . 1.0 OUTLIER -86.97 178.04 7.06 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.555 -175.172 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 44.5 mtt180 -54.73 -39.35 68.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.764 174.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.48 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 84.2 tttt -61.76 -50.68 71.39 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.86 179.053 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.538 ' HB2' ' HB2' ' A' ' 61' ' ' LEU . 24.8 m-20 -64.67 -40.05 94.73 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.928 -178.23 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 49.7 tp -59.96 -43.43 95.05 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.07 177.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.9 -13.93 62.2 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -177.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.483 HD23 HG13 ' A' ' 19' ' ' ILE . 97.3 mt -80.11 -28.05 39.09 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.723 0.297 . . . . 0.0 110.607 178.14 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.567 HD12 HD13 ' A' ' 32' ' ' LEU . 96.0 mt -104.71 140.86 37.45 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.414 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.9 m -92.11 113.12 25.3 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 170.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.551 ' CD2' HG12 ' A' ' 12' ' ' ILE . 89.6 mt -113.28 133.4 55.12 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.608 -174.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 17.1 m -129.71 142.02 43.86 Favored Pre-proline 0 C--N 1.316 -0.855 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.561 174.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -67.87 163.24 36.28 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 121.764 1.643 . . . . 0.0 111.416 179.38 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 9' ' ' SER . 75.4 mt -59.02 -63.38 1.32 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.741 175.542 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.06 -0.972 . . . . 0.0 110.007 178.965 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.8 t . . . . . 0 N--CA 1.448 -0.543 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 54.4 mtt180 -147.12 175.22 10.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.013 0.435 . . . . 0.0 110.611 176.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.1 t -114.17 135.67 53.79 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 174.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -119.92 146.58 45.66 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 -174.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.459 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 2.5 ptp180 -104.09 147.17 27.72 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.133 0.492 . . . . 0.0 110.424 178.543 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.559 HG13 ' O ' ' A' ' 36' ' ' ALA . 46.9 mt -86.28 113.39 24.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.797 178.055 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 3.5 m -68.4 -35.3 77.45 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.266 0.555 . . . . 0.0 110.146 178.26 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.421 ' HA2' ' HB3' ' A' ' 34' ' ' PRO . . . 159.15 -153.25 24.34 Favored Glycine 0 N--CA 1.44 -1.087 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.112 -178.394 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -100.5 151.62 21.35 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 120.908 0.385 . . . . 0.0 110.098 179.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.9 t -72.14 140.06 82.6 Favored Pre-proline 0 C--N 1.317 -0.833 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.557 176.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_exo -57.92 -21.03 47.32 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.664 2.243 . . . . 0.0 112.407 179.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.14 16.06 15.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.514 -177.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.475 ' HA ' HD22 ' A' ' 68' ' ' LEU . 15.7 tt -72.23 154.76 7.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.691 0.281 . . . . 0.0 110.412 179.34 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 21.6 t -84.05 143.78 29.51 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.875 0.369 . . . . 0.0 110.683 -178.051 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -64.3 132.33 49.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.472 178.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.98 -33.69 3.73 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 121.047 -0.596 . . . . 0.0 111.754 -177.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 61.4 t80 -65.83 -35.84 81.81 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.369 0.604 . . . . 0.0 109.539 176.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 24' ' ' ARG . 12.3 ttm180 -58.83 -43.11 90.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.047 174.087 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -66.1 -36.5 83.33 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.699 -179.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.419 ' O ' ' HG3' ' A' ' 30' ' ' MET . 39.4 ttm180 -67.93 -40.4 83.35 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.298 176.59 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.555 HD12 HD21 ' A' ' 69' ' ' LEU . 64.2 mt -65.04 -43.68 91.54 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.258 179.248 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -58.1 -46.47 85.48 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.224 175.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.8 t -61.16 -32.86 72.59 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.344 -0.843 . . . . 0.0 110.886 179.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' MET . . . . . 0.419 ' HG3' ' O ' ' A' ' 26' ' ' ARG . 89.4 mtp -74.65 -22.16 59.04 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.863 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 109.04 16.56 11.21 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.592 -0.813 . . . . 0.0 112.342 178.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.443 HD12 HD12 ' A' ' 69' ' ' LEU . 81.9 mt -104.04 96.96 7.01 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 178.797 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.471 ' HB2' ' HD2' ' A' ' 34' ' ' PRO . 1.8 pt? -135.67 161.09 64.98 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.342 -177.124 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.471 ' HD2' ' HB2' ' A' ' 33' ' ' LEU . 19.8 Cg_endo -59.8 131.43 39.8 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.43 2.087 . . . . 0.0 111.138 174.681 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.28 9.37 39.08 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.546 -0.835 . . . . 0.0 112.244 -178.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.559 ' O ' HG13 ' A' ' 12' ' ' ILE . . . -111.9 125.63 54.24 Favored 'General case' 0 N--CA 1.445 -0.72 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 177.35 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.459 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -99.75 138.69 36.48 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 121.12 0.486 . . . . 0.0 111.263 178.167 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 64.1 mt -119.44 141.63 48.95 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.396 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.482 ' HD3' ' HB3' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -99.32 154.08 18.46 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 173.607 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 12.5 p -95.97 128.54 47.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-O 121.314 0.578 . . . . 0.0 110.871 -177.045 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 92.8 t -88.06 -52.22 11.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.538 175.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 50.5 mtp180 -158.25 136.4 10.79 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.699 179.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.2 mp -96.73 129.51 46.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 172.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.427 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -69.38 131.28 90.26 Favored Pre-proline 0 C--N 1.324 -0.505 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 176.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 20.1 Cg_exo -66.36 4.58 0.94 Allowed 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 123.053 2.502 . . . . 0.0 113.089 -176.026 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -101.29 -23.67 14.36 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.48 179.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 97.91 -15.9 61.02 Favored Glycine 0 N--CA 1.453 -0.182 0 N-CA-C 110.536 -1.026 . . . . 0.0 110.536 -171.388 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.622 ' CB ' ' HD2' ' A' ' 49' ' ' PRO . 0.6 OUTLIER -64.85 170.29 4.25 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 114.488 -0.856 . . . . 0.0 109.888 170.901 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.645 ' HD3' ' HD3' ' A' ' 62' ' ' ARG . 3.0 Cg_exo -30.75 151.1 0.02 OUTLIER 'Trans proline' 0 C--N 1.361 1.21 0 C-N-CA 125.197 3.931 . . . . 0.0 116.395 -164.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 74.2 mt -121.2 133.34 68.1 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 CA-C-N 113.939 -1.482 . . . . 0.0 109.784 -172.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -79.41 114.37 18.29 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 177.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 35.4 m -121.26 177.55 3.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 179.036 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.482 ' HB3' ' HD3' ' A' ' 39' ' ' ARG . 0.9 OUTLIER -138.66 140.36 38.82 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 -178.119 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 12.6 m -115.0 -32.52 5.72 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 112.219 0.451 . . . . 0.0 112.219 -171.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.583 ' HG3' ' HG2' ' A' ' 56' ' ' GLN . 14.4 tpt180 -178.97 -39.71 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.694 0.283 . . . . 0.0 111.388 -170.483 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.583 ' HG2' ' HG3' ' A' ' 55' ' ' ARG . 14.5 mm100 -130.25 -47.65 1.09 Allowed 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -169.704 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.6 t -144.19 161.03 39.9 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 120.765 0.317 . . . . 0.0 110.91 -172.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.4 m -68.99 146.71 52.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.357 -178.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 58.9 tp -131.21 144.88 51.67 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.905 178.579 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -123.99 122.27 37.46 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.846 0.355 . . . . 0.0 110.256 178.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.468 ' O ' ' HA ' ' A' ' 49' ' ' PRO . 3.1 pp -122.44 140.15 53.05 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.039 179.67 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.645 ' HD3' ' HD3' ' A' ' 49' ' ' PRO . 19.3 mmt180 -67.12 170.06 7.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.449 0.642 . . . . 0.0 112.193 -175.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.4 ptm180 -60.88 -33.6 73.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.226 176.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -64.2 -49.29 72.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.625 175.432 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.454 ' OD1' ' HB2' ' A' ' 62' ' ' ARG . 4.3 m-20 -56.46 -40.82 75.48 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-O 121.223 0.535 . . . . 0.0 109.946 177.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 61.2 tp -58.42 -43.39 88.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.783 176.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -73.27 -12.68 60.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.551 -177.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.475 HD22 ' HA ' ' A' ' 19' ' ' ILE . 97.4 mt -96.8 -16.5 20.78 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.788 179.477 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.555 HD21 HD12 ' A' ' 27' ' ' LEU . 96.1 mt -116.15 118.94 34.22 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.894 0.378 . . . . 0.0 110.286 179.678 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.0 m -77.32 114.16 15.85 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.173 0.511 . . . . 0.0 110.049 -179.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.548 ' CD2' HG12 ' A' ' 12' ' ' ILE . 96.1 mt -118.59 127.62 53.77 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.453 -176.711 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 28.5 m -129.73 149.15 72.19 Favored Pre-proline 0 C--N 1.319 -0.74 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 174.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -65.97 163.39 31.29 Favored 'Trans proline' 0 N--CA 1.46 -0.46 0 C-N-CA 121.621 1.547 . . . . 0.0 111.398 177.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 89.3 mt -62.5 -41.87 99.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.164 0.507 . . . . 0.0 109.799 178.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 29.3 t70 . . . . . 0 C--O 1.248 0.994 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.476 175.819 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 18.2 m . . . . . 0 N--CA 1.435 -1.189 0 CA-C-O 120.884 0.373 . . . . 0.0 110.813 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.459 ' O ' HG12 ' A' ' 40' ' ' VAL . 35.3 mmt180 -137.26 174.57 10.47 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 121.455 0.645 . . . . 0.0 110.782 -176.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.446 ' HB2' ' CD1' ' A' ' 74' ' ' LEU . 51.1 m -113.53 133.44 55.24 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.078 172.079 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 60.5 m-85 -111.49 127.0 55.56 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -177.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.506 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 12.8 ptt180 -98.01 149.25 22.66 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.105 0.479 . . . . 0.0 110.625 -179.443 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.541 HG12 ' CD2' ' A' ' 71' ' ' LEU . 21.8 mt -90.34 118.63 36.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.007 -178.366 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 2.2 p -90.89 -12.24 36.76 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.96 0.41 . . . . 0.0 111.231 178.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.435 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 152.69 -164.81 30.84 Favored Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.717 -0.754 . . . . 0.0 111.912 176.657 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 48.0 m-85 -97.67 150.96 20.61 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 177.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.443 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 20.6 m -68.21 140.62 93.2 Favored Pre-proline 0 C--N 1.317 -0.828 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 177.088 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 23.6 Cg_exo -64.41 -0.89 3.27 Favored 'Trans proline' 0 CA--C 1.531 0.337 0 C-N-CA 123.047 2.498 . . . . 0.0 113.39 -175.847 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -105.41 17.24 24.25 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.862 0.363 . . . . 0.0 110.913 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.51 HG13 HD23 ' A' ' 68' ' ' LEU . 11.4 tt -93.73 159.76 2.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.619 -179.505 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 21.8 m -95.92 149.92 21.01 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.627 177.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -59.04 -48.7 80.63 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.411 -178.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.53 -37.16 91.76 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.959 -0.639 . . . . 0.0 112.421 -179.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.496 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 0.1 OUTLIER -72.05 -40.0 68.67 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.546 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 56.5 ttt-85 -57.08 -44.94 83.6 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.216 0.532 . . . . 0.0 110.378 175.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -62.62 -43.42 98.84 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.429 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.47 ' HG2' ' HE1' ' A' ' 30' ' ' MET . 36.6 ttm180 -61.92 -42.47 99.13 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.309 177.596 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.701 HD23 HD12 ' A' ' 32' ' ' LEU . 78.8 mt -66.27 -44.68 82.89 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.314 -179.246 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 42.5 t80 -60.65 -44.68 96.14 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.211 -179.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 54.3 m -67.5 -28.93 68.26 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.499 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' MET . . . . . 0.47 ' HE1' ' HG2' ' A' ' 26' ' ' ARG . 69.5 mtm -82.7 -18.99 38.92 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.744 -179.706 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 119.17 12.2 7.06 Favored Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 120.156 -1.021 . . . . 0.0 113.546 175.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.701 HD12 HD23 ' A' ' 27' ' ' LEU . 94.3 mt -102.75 97.45 7.61 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.67 -0.492 . . . . 0.0 109.67 177.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -131.22 152.13 80.06 Favored Pre-proline 0 N--CA 1.449 -0.502 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.89 -176.214 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.435 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 23.7 Cg_exo -64.11 136.2 50.91 Favored 'Trans proline' 0 N--CA 1.463 -0.289 0 C-N-CA 122.728 2.285 . . . . 0.0 111.723 177.039 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 108.98 -14.46 34.1 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.397 -178.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.84 -179.68 7.34 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-O 121.002 0.429 . . . . 0.0 110.094 178.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.506 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -150.69 138.76 20.12 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.954 -176.629 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.505 ' HB3' ' HB ' ' A' ' 52' ' ' VAL . 1.3 mm? -109.56 127.1 54.24 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.707 177.106 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 18.6 ttm180 -94.21 114.83 27.01 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 176.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.585 ' HA ' HG12 ' A' ' 52' ' ' VAL . 5.7 p -69.77 131.5 34.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.748 0.785 . . . . 0.0 111.858 -169.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.0 t -104.13 -36.86 4.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.723 177.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.2 ttm180 -168.17 140.09 2.91 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -177.493 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.514 HD11 HG21 ' A' ' 40' ' ' VAL . 4.5 mp -118.72 135.1 60.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 164.618 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.616 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -73.99 142.9 80.12 Favored Pre-proline 0 C--N 1.319 -0.718 0 C-N-CA 120.859 -0.336 . . . . 0.0 111.132 -179.296 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -64.9 -12.96 36.9 Favored 'Trans proline' 0 CA--C 1.529 0.274 0 C-N-CA 123.063 2.509 . . . . 0.0 112.138 177.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -59.34 -27.51 65.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.066 177.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.28 -75.03 0.24 Allowed Glycine 0 CA--C 1.494 -1.226 0 N-CA-C 110.493 -1.043 . . . . 0.0 110.493 -176.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -169.49 119.18 0.58 Allowed Pre-proline 0 N--CA 1.45 -0.473 0 CA-C-O 122.333 1.064 . . . . 0.0 112.712 173.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.616 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 55.2 Cg_endo -111.85 179.69 0.04 OUTLIER 'Trans proline' 0 N--CA 1.434 -1.998 1 C-N-CA 125.874 4.383 . . . . 0.0 106.718 136.657 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.764 HG22 HG11 ' A' ' 52' ' ' VAL . 8.4 mt -133.94 105.75 7.64 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.8 0 C-N-CA 118.205 -1.398 . . . . 0.0 110.673 176.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.502 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 25.0 tp60 -86.27 113.56 22.36 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 173.589 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.764 HG11 HG22 ' A' ' 50' ' ' ILE . 16.3 m -138.44 166.18 23.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-O 120.547 0.213 . . . . 0.0 111.101 -176.097 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -120.27 122.5 41.02 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 174.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.9 m -86.07 -78.96 0.26 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.871 -177.438 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.1 ptt180 -148.24 7.82 0.8 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.196 -179.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.3 tp60 -136.38 -64.81 0.59 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.123 0.487 . . . . 0.0 110.519 -172.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.1 t -153.22 -178.61 7.07 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 -179.059 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.488 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 26.6 m -78.9 143.03 36.27 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.345 0.593 . . . . 0.0 111.142 -179.158 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.502 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 6.3 mt -131.63 170.65 14.47 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.066 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.504 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -140.62 147.21 39.01 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.821 179.366 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.47 HD22 ' HB ' ' A' ' 50' ' ' ILE . 1.3 pt? -148.92 158.33 44.09 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.865 -0.421 . . . . 0.0 109.865 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 16.1 mmt180 -100.23 173.35 6.65 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.95 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.59 -34.88 65.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.041 -179.522 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 79.2 tttt -61.71 -51.6 67.72 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.852 0.358 . . . . 0.0 110.76 177.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.443 ' HB3' ' HB2' ' A' ' 61' ' ' LEU . 3.3 t70 -65.3 -38.66 90.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.501 0.667 . . . . 0.0 109.504 -178.525 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.565 HD21 HD13 ' A' ' 50' ' ' ILE . 59.0 tp -60.42 -39.13 86.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.138 176.19 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.02 -17.26 64.36 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.969 -176.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.51 HD23 HG13 ' A' ' 19' ' ' ILE . 86.2 mt -83.45 -25.7 30.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.0 0.429 . . . . 0.0 111.005 179.354 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.676 HD12 HD11 ' A' ' 32' ' ' LEU . 88.9 mt -109.69 131.78 54.74 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.712 -176.496 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.3 m -88.37 113.59 24.12 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 175.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.541 ' CD2' HG12 ' A' ' 12' ' ' ILE . 75.4 mt -115.82 132.45 56.64 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.506 -175.363 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.411 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 34.7 m -127.73 141.26 40.5 Favored Pre-proline 0 C--N 1.32 -0.684 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 174.311 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 72' ' ' VAL . 22.8 Cg_exo -64.65 162.29 32.02 Favored 'Trans proline' 0 C--O 1.233 0.257 0 C-N-CA 121.74 1.627 . . . . 0.0 112.343 179.392 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.446 ' CD1' ' HB2' ' A' ' 9' ' ' SER . 75.2 mt -70.31 -45.49 66.15 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.511 173.649 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 32.9 t70 . . . . . 0 C--O 1.244 0.801 0 CA-C-O 118.228 -0.892 . . . . 0.0 109.764 179.015 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 75.4 m . . . . . 0 N--CA 1.434 -1.236 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.2 mpt_? -101.05 153.41 19.58 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.206 0.527 . . . . 0.0 111.506 -170.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.572 ' HA ' ' HA ' ' A' ' 39' ' ' ARG . 30.8 m -104.99 131.86 51.96 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.519 177.354 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 43.5 m-85 -115.21 132.33 56.64 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 -179.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.459 ' HG3' HG23 ' A' ' 72' ' ' VAL . 25.5 ptt180 -99.54 145.97 26.91 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.066 0.46 . . . . 0.0 110.994 -177.706 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.567 HG12 ' CD2' ' A' ' 71' ' ' LEU . 18.0 mt -93.53 119.26 41.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.281 -177.455 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 7.4 p -92.83 -19.06 22.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.8 0.333 . . . . 0.0 111.577 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.418 ' HA2' ' HB3' ' A' ' 34' ' ' PRO . . . 164.82 -151.84 21.09 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.099 179.301 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -115.58 152.84 32.3 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.882 0.372 . . . . 0.0 110.281 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.513 ' O ' HG22 ' A' ' 19' ' ' ILE . 49.2 m -78.83 150.76 75.87 Favored Pre-proline 0 N--CA 1.442 -0.846 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.497 179.433 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -70.48 11.25 0.49 Allowed 'Trans proline' 0 N--CA 1.474 0.379 0 C-N-CA 123.161 2.574 . . . . 0.0 113.598 -176.061 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -106.23 1.82 26.35 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.757 0.313 . . . . 0.0 111.04 179.02 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.513 HG22 ' O ' ' A' ' 16' ' ' SER . 16.4 tt -89.28 143.18 11.71 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 CA-C-O 120.942 0.401 . . . . 0.0 110.735 -179.053 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 21.2 t -156.41 -174.87 5.14 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 -178.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 61.37 -155.88 0.35 Allowed 'General case' 0 CA--C 1.537 0.472 0 O-C-N 123.467 0.48 . . . . 0.0 109.768 179.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -90.17 23.64 20.19 Favored Glycine 0 CA--C 1.519 0.289 0 C-N-CA 120.896 -0.668 . . . . 0.0 112.034 178.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.453 ' CE1' HD13 ' A' ' 68' ' ' LEU . 6.3 t80 -68.45 -38.0 80.72 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.865 0.365 . . . . 0.0 110.486 -176.612 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 15.5 ttm180 -64.62 -38.96 92.8 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.804 178.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -69.72 -32.22 70.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.733 179.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.3 tpp180 -65.59 -44.16 87.48 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 175.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.438 HD23 HD12 ' A' ' 32' ' ' LEU . 89.2 mt -66.84 -41.97 86.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.472 179.498 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -56.29 -44.76 80.17 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.274 177.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 50.8 m -61.6 -33.35 73.75 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.25 178.105 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 85.1 mtp -82.52 -11.76 58.24 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.37 -179.133 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 94.61 11.16 57.27 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.835 -0.697 . . . . 0.0 111.946 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.438 HD12 HD23 ' A' ' 27' ' ' LEU . 86.7 mt -92.2 90.08 7.16 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.278 0.561 . . . . 0.0 109.787 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.3 pp -145.32 161.05 43.36 Favored Pre-proline 0 C--N 1.321 -0.674 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.773 -175.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.418 ' HB3' ' HA2' ' A' ' 14' ' ' GLY . 14.7 Cg_endo -58.03 128.15 27.74 Favored 'Trans proline' 0 C--O 1.235 0.351 0 C-N-CA 122.861 2.374 . . . . 0.0 112.011 177.192 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 111.96 -14.19 26.5 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.953 -0.642 . . . . 0.0 111.631 -176.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.528 ' HB3' HD11 ' A' ' 12' ' ' ILE . . . -93.13 -179.86 5.21 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-O 121.114 0.483 . . . . 0.0 110.16 178.587 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -154.97 146.5 23.14 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.694 -177.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 57.1 mt -130.89 132.77 45.35 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.805 177.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.572 ' HA ' ' HA ' ' A' ' 9' ' ' SER . 79.5 ttt180 -100.06 127.44 46.29 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.304 -0.407 . . . . 0.0 109.953 178.687 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.415 ' HA ' HG11 ' A' ' 52' ' ' VAL . 5.1 p -66.53 120.84 14.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 121.254 0.549 . . . . 0.0 109.967 -179.37 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.83 ' HB ' ' HG2' ' A' ' 51' ' ' GLN . 43.0 t -92.62 -59.43 3.01 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.922 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.547 173.165 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 56.0 mtm180 -156.23 160.38 39.76 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.202 0.525 . . . . 0.0 112.099 -179.02 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 80.4 mt -129.62 135.11 62.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 172.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.492 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -71.84 153.79 92.97 Favored Pre-proline 0 C--N 1.327 -0.389 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -176.284 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 25.9 Cg_exo -63.61 -17.65 60.89 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 123.678 2.919 . . . . 0.0 113.499 -179.144 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 7.1 tt -46.99 -50.4 19.21 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.958 0.885 . . . . 0.0 109.985 175.374 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.92 -46.39 0.57 Allowed Glycine 0 N--CA 1.432 -1.624 0 N-CA-C 109.799 -1.321 . . . . 0.0 109.799 -172.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -174.42 117.36 0.34 Allowed Pre-proline 0 N--CA 1.449 -0.479 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 174.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.492 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 69.4 Cg_endo -115.65 -172.87 0.02 OUTLIER 'Trans proline' 0 N--CA 1.438 -1.753 1 C-N-CA 126.969 5.112 . . . . 0.0 106.637 132.43 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.71 HG22 HG13 ' A' ' 52' ' ' VAL . 50.8 mt -140.81 117.15 7.55 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.446 0 C-N-CA 118.866 -1.134 . . . . 0.0 111.24 175.898 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.83 ' HG2' ' HB ' ' A' ' 41' ' ' VAL . 32.4 tt0 -96.55 118.32 32.79 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.051 -0.977 . . . . 0.0 108.492 174.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.71 HG13 HG22 ' A' ' 50' ' ' ILE . 15.4 m -135.81 165.9 28.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.393 0.616 . . . . 0.0 112.212 -176.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -112.91 126.14 55.14 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.06 175.527 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.4 t -82.85 -28.33 30.18 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.04 178.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.49 -43.42 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 114.982 -1.008 . . . . 0.0 108.644 177.471 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -130.21 -37.1 1.47 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.705 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.7 t -106.83 158.76 16.75 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.738 -177.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.413 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 15.3 m -101.82 157.53 16.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.67 -177.26 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.505 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 8.7 mt -135.71 163.82 29.29 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.061 0.458 . . . . 0.0 111.465 179.121 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.563 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -140.73 135.51 31.63 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.333 175.098 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -159.49 178.65 9.67 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 -175.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.438 ' HD3' ' HA ' ' A' ' 62' ' ' ARG . 9.8 mmt85 -109.43 169.1 8.92 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.7 0.762 . . . . 0.0 112.299 179.516 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.1 ptp180 -60.81 -37.55 82.39 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.181 -1.372 . . . . 0.0 112.328 -174.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -59.81 -46.56 88.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.164 0.507 . . . . 0.0 110.678 178.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -66.48 -37.08 84.31 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.159 -176.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.564 HD21 ' CD1' ' A' ' 50' ' ' ILE . 4.6 tp -71.4 -38.71 71.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.692 176.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.07 -21.94 65.86 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.727 -0.669 . . . . 0.0 112.121 -175.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.453 HD13 ' CE1' ' A' ' 23' ' ' TYR . 60.5 mt -79.2 -12.71 59.97 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.456 -0.497 . . . . 0.0 110.555 177.144 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.402 HD12 HD11 ' A' ' 32' ' ' LEU . 82.2 mt -97.09 138.03 35.23 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 171.85 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 17.7 m -88.4 113.87 24.44 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 173.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.567 ' CD2' HG12 ' A' ' 12' ' ' ILE . 77.3 mt -116.86 134.1 55.19 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.907 -175.28 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.459 HG23 ' HG3' ' A' ' 11' ' ' ARG . 29.4 m -125.51 138.92 32.77 Favored Pre-proline 0 C--N 1.317 -0.825 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 172.026 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -65.04 165.02 22.89 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 121.669 1.579 . . . . 0.0 111.286 177.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 9' ' ' SER . 89.6 mt -51.9 -31.59 29.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.525 174.815 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 38.2 t70 . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.524 -0.751 . . . . 0.0 110.654 178.655 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.52 ' O ' ' HG3' ' A' ' 8' ' ' ARG . 36.5 t . . . . . 0 N--CA 1.452 -0.365 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.52 ' HG3' ' O ' ' A' ' 7' ' ' SER . 39.1 mtp85 -155.36 153.12 29.98 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 179.758 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.486 ' HB2' ' CD1' ' A' ' 74' ' ' LEU . 52.1 m -63.24 146.1 54.12 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.252 0.549 . . . . 0.0 111.058 -177.255 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -117.27 125.2 50.72 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.996 -177.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.544 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 26.2 ptt180 -95.01 154.18 17.29 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.069 0.461 . . . . 0.0 110.716 -178.217 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.487 HG12 ' CD2' ' A' ' 71' ' ' LEU . 18.4 mt -94.89 119.45 42.94 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.117 -177.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 4.5 p -94.46 -17.86 22.06 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.637 0.256 . . . . 0.0 111.254 179.012 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.996 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 161.32 -161.12 32.8 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.44 -0.886 . . . . 0.0 112.283 177.805 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 65.8 m-85 -110.47 156.39 20.92 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.605 -0.516 . . . . 0.0 109.605 177.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.477 ' O ' HG23 ' A' ' 19' ' ' ILE . 49.1 m -72.77 132.17 83.45 Favored Pre-proline 0 N--CA 1.442 -0.838 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 174.376 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -63.82 2.53 0.99 Allowed 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 123.325 2.683 . . . . 0.0 113.746 -174.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.01 -9.31 37.26 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.018 177.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.692 HD11 ' HB3' ' A' ' 68' ' ' LEU . 11.8 tt -84.49 143.54 11.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.107 0.48 . . . . 0.0 110.784 -178.247 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 41.2 m -84.12 158.24 21.45 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.354 177.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -63.74 -37.5 87.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.537 -173.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.46 ' O ' ' HB2' ' A' ' 25' ' ' GLN . . . -64.08 -41.27 98.55 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.679 -178.052 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -75.51 -32.87 60.67 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 178.427 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 40.3 ttt-85 -58.58 -35.39 72.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.437 172.469 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.46 ' HB2' ' O ' ' A' ' 22' ' ' GLY . 21.0 mt-30 -65.12 -33.5 76.17 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.621 177.231 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.6 tmm_? -66.01 -41.32 91.14 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.089 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 96.2 mt -69.1 -44.67 71.99 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.447 178.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -59.4 -43.94 92.91 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.83 179.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.4 m -63.59 -32.95 74.57 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.935 178.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 77.5 mtp -77.5 -15.82 59.08 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.094 178.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 95.29 15.87 42.68 Favored Glycine 0 N--CA 1.446 -0.681 0 C-N-CA 120.877 -0.678 . . . . 0.0 111.93 178.612 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.433 HD12 HD11 ' A' ' 69' ' ' LEU . 90.8 mt -92.69 79.44 4.79 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.62 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.6 pp -132.97 162.08 59.79 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.98 -173.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.996 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 35.2 Cg_exo -58.46 122.07 11.04 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.785 2.323 . . . . 0.0 112.119 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.46 -17.05 9.69 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.344 -179.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -94.6 -176.11 3.81 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 177.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.544 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -157.34 138.95 13.97 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.957 -177.633 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.433 ' N ' HD21 ' A' ' 38' ' ' LEU . 2.5 mm? -99.65 135.8 40.53 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 176.142 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.449 HH11 ' HD2' ' A' ' 39' ' ' ARG . 21.8 ttt180 -96.18 111.24 23.35 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.834 -178.423 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 7.8 p -60.48 127.08 19.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.438 0.637 . . . . 0.0 111.495 -177.424 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 49.6 t -103.55 -55.2 5.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.472 173.136 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 48.4 mtm180 -152.33 168.09 26.54 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.87 179.47 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.418 HG13 HG21 ' A' ' 50' ' ' ILE . 4.7 mp -124.49 139.37 50.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 174.049 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.45 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -68.82 135.29 89.99 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 120.633 0.254 . . . . 0.0 110.461 178.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 23.9 Cg_exo -65.74 -1.57 5.18 Favored 'Trans proline' 0 N--CA 1.475 0.419 0 C-N-CA 123.117 2.545 . . . . 0.0 113.195 -178.315 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -94.38 -16.94 23.03 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.812 179.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.472 ' O ' ' HD2' ' A' ' 63' ' ' ARG . . . 91.88 -9.53 76.5 Favored Glycine 0 N--CA 1.454 -0.15 0 N-CA-C 110.417 -1.073 . . . . 0.0 110.417 -171.178 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.899 ' HB3' ' HD2' ' A' ' 49' ' ' PRO . 6.5 m-20 -74.2 171.55 10.88 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 114.022 -1.089 . . . . 0.0 110.285 174.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.899 ' HD2' ' HB3' ' A' ' 48' ' ' ASP . 14.4 Cg_exo -24.43 152.13 0.0 OUTLIER 'Trans proline' 0 C--N 1.362 1.289 1 C-N-CA 126.316 4.678 . . . . 0.0 117.291 -167.665 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.5 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 71.0 mt -109.89 138.3 38.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-N 113.638 -1.619 . . . . 0.0 109.602 -171.345 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -86.72 108.92 18.89 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 35.8 m -121.18 -179.43 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.483 ' HA ' ' HA ' ' A' ' 58' ' ' SER . 34.0 tt0 -136.87 134.36 36.79 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 179.648 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.0 p -84.07 -45.86 12.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.325 0.583 . . . . 0.0 110.317 -177.105 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 28.8 ttm180 -161.8 -59.19 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.331 -0.849 . . . . 0.0 108.98 177.038 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -111.3 -39.27 4.75 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.308 177.914 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.8 t -103.06 149.87 24.15 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.912 0.387 . . . . 0.0 111.135 -172.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.483 ' HA ' ' HA ' ' A' ' 53' ' ' GLU . 21.3 m -95.17 152.09 18.65 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.576 179.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 53.1 tp -143.17 146.82 34.05 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.897 -177.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.5 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -112.28 124.82 53.3 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.95 176.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.655 HD13 HD11 ' A' ' 66' ' ' LEU . 1.3 pp -109.66 125.63 52.82 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.066 0.46 . . . . 0.0 110.584 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.435 ' HG3' ' HG3' ' A' ' 49' ' ' PRO . 2.9 mpt_? -67.24 171.98 5.24 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.068 -177.743 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.472 ' HD2' ' O ' ' A' ' 47' ' ' GLY . 0.0 OUTLIER -67.27 -44.52 79.13 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.589 179.445 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 60.0 tttp -70.71 -40.37 72.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.972 0.415 . . . . 0.0 110.324 177.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -63.75 -35.23 79.88 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.967 178.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.655 HD11 HD13 ' A' ' 61' ' ' LEU . 40.7 tp -68.81 -38.13 79.71 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.561 174.468 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.01 -15.43 63.02 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.903 -176.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.692 ' HB3' HD11 ' A' ' 19' ' ' ILE . 72.0 mt -83.87 -24.75 30.73 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.011 0.434 . . . . 0.0 110.751 177.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.433 HD11 HD12 ' A' ' 32' ' ' LEU . 87.8 mt -102.81 141.77 35.06 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.446 179.652 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.1 m -96.42 113.42 25.0 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 170.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.487 ' CD2' HG12 ' A' ' 12' ' ' ILE . 51.7 mt -121.19 137.1 54.83 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.628 -176.263 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 34.6 m -132.36 150.24 75.37 Favored Pre-proline 0 C--N 1.321 -0.653 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 174.053 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -60.21 163.75 13.95 Favored 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 121.863 1.708 . . . . 0.0 111.716 177.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.486 ' CD1' ' HB2' ' A' ' 9' ' ' SER . 74.8 mt -66.22 -12.17 54.48 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.022 175.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.3 t70 . . . . . 0 C--O 1.249 1.033 0 O-C-N 124.285 0.991 . . . . 0.0 110.311 -178.095 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 ptm . . . . . 0 N--CA 1.478 0.934 0 CA-C-O 120.573 0.225 . . . . 0.0 110.493 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.8 m -116.43 81.2 1.58 Allowed 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 175.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 65.24 176.84 0.2 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.253 -170.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.852 ' HB3' HG12 ' A' ' 41' ' ' VAL . 61.1 tp -146.12 99.02 3.19 Favored 'General case' 0 C--N 1.322 -0.618 0 O-C-N 122.229 -0.294 . . . . 0.0 110.567 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 53.21 72.27 1.2 Allowed Pre-proline 0 CA--C 1.531 0.238 0 O-C-N 124.037 0.835 . . . . 0.0 111.288 178.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -75.41 117.27 4.76 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 122.361 2.04 . . . . 0.0 112.074 -177.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 35.3 t -94.13 -48.77 6.06 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.87 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.47 ' O ' HG12 ' A' ' 40' ' ' VAL . 54.0 mtt180 -145.72 159.65 42.86 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.425 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.408 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 69.4 m -120.82 133.92 55.3 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.717 173.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.532 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 56.6 m-85 -114.35 129.21 56.64 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.666 -177.52 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.554 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 85.0 mtt180 -92.38 157.9 16.36 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.0 0.429 . . . . 0.0 110.692 178.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 51.8 mt -95.74 104.79 16.23 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 173.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.551 ' HB ' HG21 ' A' ' 72' ' ' VAL . 2.9 t -81.94 -14.61 55.86 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.128 0.49 . . . . 0.0 110.444 -175.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.722 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 157.93 -163.68 32.86 Favored Glycine 0 N--CA 1.442 -0.956 0 C-N-CA 120.886 -0.674 . . . . 0.0 112.038 179.308 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -97.71 153.38 18.28 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.427 ' O ' HG21 ' A' ' 19' ' ' ILE . 88.7 p -74.38 162.17 74.95 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.869 -179.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_exo -71.39 -12.64 29.88 Favored 'Trans proline' 0 CA--C 1.529 0.229 0 C-N-CA 122.58 2.186 . . . . 0.0 112.095 174.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -89.12 -0.99 57.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.742 -178.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.445 HD12 ' CA ' ' A' ' 24' ' ' ARG . 18.6 tt -65.6 124.92 21.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.984 0.421 . . . . 0.0 110.017 179.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.5 m -138.77 159.35 42.34 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.848 -0.341 . . . . 0.0 111.876 -172.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 64.1 t30 60.46 41.19 16.22 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 115.549 -0.75 . . . . 0.0 112.687 168.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 70.19 21.97 77.28 Favored Glycine 0 C--N 1.331 0.261 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.988 174.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.5 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -65.88 -23.18 66.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.729 0.265 . . . . 0.0 111.294 179.823 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.445 ' CA ' HD12 ' A' ' 19' ' ' ILE . 6.0 ttm-85 -59.61 -36.3 76.05 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 121.342 0.592 . . . . 0.0 109.507 176.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -69.24 -36.42 77.16 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.781 179.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 25.2 tpp180 -67.01 -42.22 85.33 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 176.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' A' ' 23' ' ' TYR . 84.1 mt -66.15 -43.13 87.87 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.232 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -61.55 -41.36 97.24 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.175 0.512 . . . . 0.0 110.242 178.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 63.3 m -60.47 -35.69 76.5 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.801 175.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 71.4 mtm -84.29 -11.52 56.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.613 -178.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 93.55 27.72 12.56 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.911 -0.662 . . . . 0.0 112.662 177.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.592 HD11 HD11 ' A' ' 69' ' ' LEU . 94.5 mt -105.74 102.77 12.2 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.083 0.468 . . . . 0.0 110.573 178.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.438 HD22 ' N ' ' A' ' 33' ' ' LEU . 1.8 pt? -138.02 157.11 73.63 Favored Pre-proline 0 N--CA 1.448 -0.574 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.225 -179.35 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.722 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 28.6 Cg_exo -62.13 136.8 62.6 Favored 'Trans proline' 0 C--O 1.233 0.275 0 C-N-CA 122.573 2.182 . . . . 0.0 111.92 178.05 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 114.69 -17.74 17.85 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.323 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -86.03 175.99 8.27 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-O 121.046 0.451 . . . . 0.0 110.215 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.554 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -148.56 148.18 29.88 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.045 -177.151 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 49.0 mt -122.7 130.24 52.72 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.084 178.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 14.5 ttm180 -98.13 119.6 37.07 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.41 178.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.47 HG12 ' O ' ' A' ' 8' ' ' ARG . 13.4 p -61.3 127.3 20.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -171.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.852 HG12 ' HB3' ' A' ' 4' ' ' LEU . 76.1 t -98.0 -54.66 6.75 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 165.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.443 ' HB3' ' O ' ' A' ' 41' ' ' VAL . 15.9 ptt180 173.3 156.14 0.11 Allowed 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.359 0.6 . . . . 0.0 111.944 174.67 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 84.4 mt -118.15 142.27 33.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 170.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.619 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -74.81 134.04 75.67 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-O 120.501 0.191 . . . . 0.0 110.556 176.806 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -66.8 -19.86 52.66 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 123.233 2.622 . . . . 0.0 112.999 -174.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -51.48 -44.85 62.58 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.567 0.699 . . . . 0.0 110.509 176.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -174.97 -74.16 0.05 OUTLIER Glycine 0 N--CA 1.431 -1.651 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.328 -177.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.513 ' OD1' ' HD3' ' A' ' 63' ' ' ARG . 6.8 p-10 -177.97 127.16 0.28 Allowed Pre-proline 0 N--CA 1.442 -0.858 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 -179.088 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.619 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 73.5 Cg_endo -114.28 -168.2 0.02 OUTLIER 'Trans proline' 0 N--CA 1.43 -2.236 0 C-N-CA 124.482 3.455 . . . . 0.0 106.569 129.295 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.738 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 58.6 mt -145.1 99.9 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.35 0 C-N-CA 119.93 -0.708 . . . . 0.0 109.432 170.781 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -86.41 121.45 28.98 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 174.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.45 HG12 ' HA ' ' A' ' 40' ' ' VAL . 9.5 m -142.22 172.76 8.48 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.927 -179.047 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -122.22 150.82 41.75 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 177.078 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 29.3 p -120.11 -30.46 4.66 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -173.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 27.2 tpt180 178.61 -54.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.864 -175.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -143.82 4.79 1.32 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.568 -179.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.9 t -149.93 138.73 20.91 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.234 0.54 . . . . 0.0 111.063 -175.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.1 p -80.22 148.78 30.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.402 -178.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.573 HD11 ' N ' ' A' ' 60' ' ' ALA . 2.4 tm? -129.56 148.73 51.49 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.22 -0.445 . . . . 0.0 109.906 -178.366 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.738 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -139.72 148.11 41.85 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.969 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.593 HD12 HD13 ' A' ' 50' ' ' ILE . 3.9 pp -162.98 -179.18 6.56 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.543 -0.539 . . . . 0.0 109.543 -179.066 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 26.0 mmm-85 -110.83 170.06 8.35 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 122.03 0.919 . . . . 0.0 112.286 -177.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.513 ' HD3' ' OD1' ' A' ' 48' ' ' ASP . 18.1 ptt-85 -62.98 -35.17 79.28 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 113.771 -1.559 . . . . 0.0 111.455 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -71.52 -33.95 69.64 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.015 -178.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -75.31 -36.73 61.07 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.389 0.614 . . . . 0.0 109.536 176.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.615 HD12 HD13 ' A' ' 71' ' ' LEU . 37.6 tp -64.38 -30.39 71.43 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.737 175.028 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.09 -9.77 48.76 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.591 -178.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.455 ' HB3' HD13 ' A' ' 27' ' ' LEU . 63.6 mt -91.79 -5.38 53.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.041 0.448 . . . . 0.0 110.568 175.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.592 HD11 HD11 ' A' ' 32' ' ' LEU . 95.8 mt -119.83 153.75 35.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.952 -178.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 15.8 m -113.3 121.22 43.76 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.02 -0.537 . . . . 0.0 109.577 170.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.615 HD13 HD12 ' A' ' 66' ' ' LEU . 64.8 mt -103.46 146.37 28.62 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.263 0.554 . . . . 0.0 111.578 -175.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.551 HG21 ' HB ' ' A' ' 13' ' ' THR . 12.3 m -129.49 117.86 18.82 Favored Pre-proline 0 C--N 1.322 -0.63 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.669 173.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.532 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 7.9 Cg_exo -70.95 163.02 40.67 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 121.995 1.796 . . . . 0.0 111.728 -178.416 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 9' ' ' SER . 86.7 mt -58.33 -47.95 82.1 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 172.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 . . . . . 0 C--O 1.25 1.116 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.72 174.685 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.4 ptt? . . . . . 0 N--CA 1.481 1.124 0 CA-C-O 121.282 0.563 . . . . 0.0 110.682 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.8 m -159.71 -56.3 0.06 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.204 178.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 48.52 90.18 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.306 0 O-C-N 124.382 1.051 . . . . 0.0 113.173 175.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -70.84 -24.52 62.54 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 174.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 72.57 148.98 0.12 Allowed Pre-proline 0 N--CA 1.468 0.457 0 CA-C-N 115.106 -0.952 . . . . 0.0 112.144 176.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.505 ' HB3' ' O ' ' A' ' 40' ' ' VAL . 27.2 Cg_endo -63.84 110.06 1.22 Allowed 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.965 2.443 . . . . 0.0 112.059 177.357 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.515 ' HB3' ' HD3' ' A' ' 8' ' ' ARG . 22.9 t -99.23 -49.81 4.35 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.183 178.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.515 ' HD3' ' HB3' ' A' ' 7' ' ' SER . 0.0 OUTLIER -143.82 157.09 44.61 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.282 -179.864 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.425 ' HB2' ' CD1' ' A' ' 74' ' ' LEU . 15.3 m -105.1 164.13 12.04 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 176.021 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -127.87 132.84 49.33 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.865 -0.334 . . . . 0.0 110.989 -176.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.465 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 17.1 mtp180 -91.1 152.23 20.7 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.18 -0.464 . . . . 0.0 109.771 175.093 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.532 HG12 ' CD2' ' A' ' 71' ' ' LEU . 33.5 mt -102.9 117.62 48.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 176.495 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 2.9 p -87.34 -24.47 24.26 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.11 0.481 . . . . 0.0 110.74 177.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 165.62 -154.19 24.71 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.822 -0.704 . . . . 0.0 111.752 -179.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.45 ' CE1' ' HG3' ' A' ' 24' ' ' ARG . 44.9 m-85 -113.82 152.97 29.9 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 -177.016 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.406 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 20.9 m -70.35 140.21 87.47 Favored Pre-proline 0 C--N 1.319 -0.741 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.395 177.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 34.8 Cg_exo -61.57 -20.51 69.02 Favored 'Trans proline' 0 CA--C 1.529 0.265 0 C-N-CA 122.874 2.382 . . . . 0.0 112.22 179.524 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.68 29.24 2.37 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.933 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.493 HG13 HD23 ' A' ' 68' ' ' LEU . 19.8 tt -74.58 149.72 7.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.534 179.003 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.501 ' O ' ' HB2' ' A' ' 23' ' ' TYR . 9.3 m -89.43 117.94 28.72 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -173.153 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 24.47 88.15 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 115.407 1.632 . . . . 0.0 115.407 165.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.66 9.13 55.05 Favored Glycine 0 CA--C 1.517 0.176 0 N-CA-C 114.797 0.679 . . . . 0.0 114.797 171.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.501 ' HB2' ' O ' ' A' ' 20' ' ' SER . 0.9 OUTLIER -64.97 -23.06 67.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 117.75 0.775 . . . . 0.0 111.37 179.785 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.45 ' HG3' ' CE1' ' A' ' 15' ' ' TYR . 34.2 ttm180 -56.02 -46.58 78.75 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 121.165 0.507 . . . . 0.0 110.0 174.083 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -65.04 -34.48 78.54 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.996 -178.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 33.9 ttm180 -73.16 -39.85 65.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.157 178.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 23' ' ' TYR . 95.3 mt -68.68 -43.57 75.84 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.26 -178.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -60.89 -42.44 97.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.248 179.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 69.9 m -67.4 -31.05 71.01 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.22 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.413 ' CE ' HD23 ' A' ' 27' ' ' LEU . 68.0 mtm -79.16 -27.67 42.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.233 179.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 124.48 4.51 7.52 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.32 -0.943 . . . . 0.0 112.857 177.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.533 HD11 HD13 ' A' ' 69' ' ' LEU . 92.1 mt -97.15 93.73 6.73 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 pp -139.05 159.05 68.38 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.615 -173.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.25 121.56 10.12 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.787 2.325 . . . . 0.0 112.08 177.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 114.74 -19.92 15.58 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 121.055 -0.593 . . . . 0.0 111.797 -176.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.505 ' O ' HG13 ' A' ' 12' ' ' ILE . . . -83.81 106.9 15.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.227 0.537 . . . . 0.0 110.46 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.465 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -88.58 116.33 26.75 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.772 177.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.47 HD11 HG21 ' A' ' 52' ' ' VAL . 70.5 mt -94.59 134.15 37.45 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.311 0.577 . . . . 0.0 110.236 -177.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 49.5 ttt180 -98.25 115.1 27.67 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.728 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.518 ' HA ' HG12 ' A' ' 52' ' ' VAL . 99.4 t -64.03 120.43 10.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 123.402 0.439 . . . . 0.0 111.275 -178.519 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.672 HG12 ' HG3' ' A' ' 42' ' ' ARG . 53.1 t -98.14 -53.56 7.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.52 174.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.672 ' HG3' HG12 ' A' ' 41' ' ' VAL . 25.7 mtp180 -148.46 140.12 23.66 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -173.279 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.2 mp -120.14 141.11 41.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 168.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.757 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -79.39 134.5 58.45 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-O 120.566 0.222 . . . . 0.0 110.868 176.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -64.64 -7.56 14.95 Favored 'Trans proline' 0 N--CA 1.479 0.636 0 C-N-CA 123.384 2.723 . . . . 0.0 113.159 -177.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.15 -37.93 81.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.593 0.711 . . . . 0.0 110.891 175.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.446 ' O ' ' HB2' ' A' ' 48' ' ' ASP . . . 174.3 -76.42 0.08 OUTLIER Glycine 0 N--CA 1.436 -1.332 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 -175.517 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.446 ' HB2' ' O ' ' A' ' 47' ' ' GLY . 17.2 t70 -179.58 118.37 0.22 Allowed Pre-proline 0 N--CA 1.453 -0.306 0 N-CA-C 113.658 0.985 . . . . 0.0 113.658 173.131 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.757 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 30.7 Cg_endo -111.49 160.77 0.05 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.441 1 C-N-CA 126.049 4.499 . . . . 0.0 108.835 139.309 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.646 HG21 HG11 ' A' ' 52' ' ' VAL . 2.7 mp -119.64 106.09 18.51 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.69 0 C-N-CA 118.89 -1.124 . . . . 0.0 110.028 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.54 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 0.8 OUTLIER -86.5 111.8 20.92 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 174.436 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.646 HG11 HG21 ' A' ' 50' ' ' ILE . 21.4 m -124.01 173.15 10.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.305 0.574 . . . . 0.0 111.922 -174.181 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -120.02 128.27 53.38 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.912 179.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.5 m -86.16 -40.01 16.08 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 173.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 26.2 ttp85 -179.63 -49.88 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.781 -1.099 . . . . 0.0 108.537 173.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -128.63 -24.22 3.04 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.095 174.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.8 t -93.12 138.95 31.08 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 121.131 0.491 . . . . 0.0 109.679 177.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 21.7 m -109.35 137.18 47.6 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.672 178.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.54 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 12.1 mt -123.84 152.13 42.64 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.98 -177.193 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.408 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -129.98 118.61 21.89 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 114.946 -1.025 . . . . 0.0 109.16 177.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.473 ' HB2' ' HB2' ' A' ' 65' ' ' ASP . 0.7 OUTLIER -124.26 150.05 45.78 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -174.74 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.584 ' N ' ' HD3' ' A' ' 62' ' ' ARG . 0.8 OUTLIER -97.89 176.43 5.79 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 120.953 0.406 . . . . 0.0 110.436 -176.154 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -54.01 -34.42 59.85 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.086 175.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.1 -45.72 90.14 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.981 177.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.473 ' HB2' ' HB2' ' A' ' 61' ' ' LEU . 5.1 m-20 -67.34 -41.68 84.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.064 178.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 62.1 tp -59.07 -37.82 77.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.822 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.97 -25.01 66.91 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.55 -178.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.493 HD23 HG13 ' A' ' 19' ' ' ILE . 81.8 mt -88.97 -15.83 33.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.236 -176.367 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.533 HD13 HD11 ' A' ' 32' ' ' LEU . 96.3 mt -110.33 143.2 40.91 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.965 0.412 . . . . 0.0 111.258 -175.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 20.4 m -101.57 114.1 27.84 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 172.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.532 ' CD2' HG12 ' A' ' 12' ' ' ILE . 75.0 mt -111.4 143.8 41.63 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.212 -174.517 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.501 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 16.3 m -126.37 123.77 24.24 Favored Pre-proline 0 C--N 1.317 -0.818 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.215 173.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.501 ' HD3' ' HA ' ' A' ' 72' ' ' VAL . 13.5 Cg_exo -70.01 161.48 45.82 Favored 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 122.201 1.934 . . . . 0.0 112.427 -175.407 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.425 ' CD1' ' HB2' ' A' ' 9' ' ' SER . 66.9 mt -74.89 -38.88 61.76 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.007 171.539 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.2 t70 . . . . . 0 C--O 1.25 1.096 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.211 -178.821 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.1 tmm? . . . . . 0 N--CA 1.477 0.888 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.9 m -109.31 129.27 55.52 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.346 179.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -83.05 80.42 9.05 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.181 0.515 . . . . 0.0 110.147 178.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.3 tt -101.61 117.84 35.73 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.474 -175.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -151.33 98.62 3.07 Favored Pre-proline 0 C--N 1.322 -0.628 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 174.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.544 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 68.0 Cg_endo -74.26 161.25 40.91 Favored 'Trans proline' 0 N--CA 1.462 -0.372 0 C-N-CA 122.908 2.405 . . . . 0.0 113.216 -172.481 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 31.8 t -122.36 -74.71 0.61 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.496 178.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 47.1 mtp180 -128.64 167.68 16.84 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 120.816 0.341 . . . . 0.0 110.91 -178.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.49 ' HB2' HD11 ' A' ' 74' ' ' LEU . 21.7 m -121.93 142.89 49.82 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.058 0.456 . . . . 0.0 111.621 -173.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.416 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 73.2 m-85 -123.11 135.71 54.49 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.001 179.222 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.511 ' HG3' HG22 ' A' ' 72' ' ' VAL . 34.5 ptt180 -107.06 154.24 21.42 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.071 0.462 . . . . 0.0 110.48 179.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.432 HG12 ' CD2' ' A' ' 71' ' ' LEU . 26.6 mt -99.21 114.54 37.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.624 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 12.3 t -89.51 -18.44 26.66 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.755 0.312 . . . . 0.0 110.91 -177.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.567 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 167.39 -168.24 40.39 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.855 -0.688 . . . . 0.0 111.569 179.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -102.02 155.8 17.95 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.969 0.384 . . . . 0.0 110.315 177.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.496 ' O ' HG23 ' A' ' 19' ' ' ILE . 23.5 m -76.68 145.01 74.25 Favored Pre-proline 0 N--CA 1.442 -0.854 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.598 175.169 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -62.91 0.39 1.61 Allowed 'Trans proline' 0 N--CA 1.477 0.512 0 C-N-CA 123.21 2.607 . . . . 0.0 114.088 -173.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.94 3.63 54.74 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.764 0.316 . . . . 0.0 111.151 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.496 HG23 ' O ' ' A' ' 16' ' ' SER . 15.4 tt -84.63 124.59 39.98 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-O 121.371 0.605 . . . . 0.0 110.793 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.2 m -156.12 -176.08 5.77 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.985 -177.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 66.2 t30 64.01 29.27 14.34 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 122.949 0.5 . . . . 0.0 112.06 170.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 81.8 5.56 89.72 Favored Glycine 0 N--CA 1.454 -0.166 0 C-N-CA 121.13 -0.557 . . . . 0.0 113.141 176.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -61.4 -26.46 67.87 Favored 'General case' 0 C--N 1.33 -0.262 0 O-C-N 122.704 -0.292 . . . . 0.0 111.631 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.442 ' HA ' HD11 ' A' ' 19' ' ' ILE . 12.3 ttm180 -64.97 -40.53 95.12 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.826 0.346 . . . . 0.0 110.198 178.336 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -61.66 -43.92 97.94 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.279 178.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.44 ' HG2' ' HE2' ' A' ' 30' ' ' MET . 40.4 ttm180 -60.65 -42.88 97.86 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.296 178.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 75.7 mt -70.26 -41.59 73.27 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.497 -178.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -60.35 -46.41 90.03 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.261 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 74.5 m -65.59 -28.35 69.07 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.588 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.44 ' HE2' ' HG2' ' A' ' 26' ' ' ARG . 69.4 mtm -85.04 -9.26 58.18 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.959 178.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 96.34 24.44 14.31 Favored Glycine 0 C--N 1.33 0.218 0 C-N-CA 120.932 -0.651 . . . . 0.0 112.992 174.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.601 HD11 HD12 ' A' ' 69' ' ' LEU . 84.8 mt -112.28 94.09 4.76 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.897 0.379 . . . . 0.0 110.196 179.387 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -137.96 159.61 67.85 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.381 -178.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.567 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 17.9 Cg_exo -66.23 138.73 52.49 Favored 'Trans proline' 0 N--CA 1.464 -0.256 0 C-N-CA 122.512 2.142 . . . . 0.0 111.495 177.46 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 100.65 -1.02 55.48 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.675 -0.774 . . . . 0.0 111.863 -177.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -103.43 -174.76 2.62 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 176.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.428 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -159.79 151.25 19.87 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.717 -176.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.576 HD11 HG21 ' A' ' 52' ' ' VAL . 85.4 mt -131.86 138.48 48.47 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.618 178.714 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 -110.37 127.43 55.06 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.924 -178.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.544 ' O ' ' HA ' ' A' ' 6' ' ' PRO . 8.5 p -65.5 126.04 23.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.351 0.596 . . . . 0.0 111.216 -175.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.602 HG12 ' HG3' ' A' ' 42' ' ' ARG . 65.2 t -96.83 -57.72 4.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.43 -0.804 . . . . 0.0 109.587 172.363 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.602 ' HG3' HG12 ' A' ' 41' ' ' VAL . 57.3 mtp180 -146.93 158.84 44.03 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.597 -179.189 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 61.2 mt -117.71 141.26 37.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.452 ' HB2' ' O ' ' A' ' 48' ' ' ASP . . . -72.21 150.8 92.21 Favored Pre-proline 0 C--O 1.233 0.222 0 CA-C-O 120.606 0.241 . . . . 0.0 110.859 178.851 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -54.89 -18.39 16.37 Favored 'Trans proline' 0 CA--C 1.535 0.534 0 C-N-CA 123.657 2.904 . . . . 0.0 114.854 -174.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 77.5 mt -103.41 -31.53 9.96 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 -175.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 118.18 -27.99 7.12 Favored Glycine 0 N--CA 1.453 -0.178 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 -171.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.805 ' HB3' ' HD2' ' A' ' 49' ' ' PRO . 0.2 OUTLIER -61.16 170.32 1.67 Allowed Pre-proline 0 C--O 1.221 -0.439 0 CA-C-O 118.346 -0.835 . . . . 0.0 109.113 168.47 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.805 ' HD2' ' HB3' ' A' ' 48' ' ' ASP . 17.1 Cg_exo -18.67 150.77 0.0 OUTLIER 'Trans proline' 0 C--N 1.362 1.273 1 C-N-CA 126.582 4.855 . . . . 0.0 117.988 -153.623 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 67.0 mt -123.91 140.37 47.56 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.971 0 CA-C-N 113.579 -1.646 . . . . 0.0 110.103 -170.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -84.37 112.63 20.51 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 178.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.576 HG21 HD11 ' A' ' 38' ' ' LEU . 26.7 m -119.41 168.92 11.15 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 120.738 0.304 . . . . 0.0 110.729 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -125.83 142.61 51.43 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.025 -176.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 11.8 m -96.87 -59.5 1.79 Allowed 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 172.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -141.65 -35.22 0.46 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.175 -0.92 . . . . 0.0 109.39 176.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -151.21 -35.06 0.14 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.775 173.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 2.0 m -67.25 135.04 52.78 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.914 -178.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.45 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 5.6 m -96.96 133.31 41.78 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.045 176.305 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.5 mp -115.98 148.08 40.5 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.281 -179.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -145.56 114.15 6.78 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.904 177.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.536 HD12 HD13 ' A' ' 66' ' ' LEU . 2.9 pp -135.96 153.6 51.36 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.592 -178.17 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.598 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 24.2 mmt180 -64.49 166.53 8.27 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.496 0.665 . . . . 0.0 112.02 -176.057 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 56.8 mtm180 -75.06 -32.94 61.65 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.045 178.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -58.33 -39.8 80.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.827 173.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -75.49 -40.13 57.66 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.601 178.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.679 HD12 HD11 ' A' ' 71' ' ' LEU . 26.9 tp -64.12 -26.62 68.62 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.779 179.614 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.89 -19.67 65.03 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.413 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 96.1 mt -73.47 -25.06 60.31 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.959 0.409 . . . . 0.0 110.545 178.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.601 HD12 HD11 ' A' ' 32' ' ' LEU . 75.7 mt -98.11 130.99 44.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.168 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 27.0 m -89.25 114.29 25.62 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 174.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.679 HD11 HD12 ' A' ' 66' ' ' LEU . 83.0 mt -110.74 144.2 40.07 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.284 -171.33 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.511 HG22 ' HG3' ' A' ' 11' ' ' ARG . 5.1 m -136.62 135.38 20.38 Favored Pre-proline 0 C--N 1.318 -0.762 0 CA-C-N 115.045 -0.979 . . . . 0.0 109.028 171.35 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.416 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 5.4 Cg_exo -72.93 162.83 40.01 Favored 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 121.897 1.732 . . . . 0.0 112.167 -177.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.49 HD11 ' HB2' ' A' ' 9' ' ' SER . 74.8 mt -82.81 -36.02 25.91 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 171.002 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 34.0 t70 . . . . . 0 C--O 1.253 1.26 0 CA-C-N 114.336 -1.302 . . . . 0.0 109.234 170.714 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.4 mmt . . . . . 0 N--CA 1.48 1.064 0 CA-C-O 121.019 0.438 . . . . 0.0 111.306 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.8 m -94.43 53.35 1.67 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.693 -170.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -86.98 95.95 10.1 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 173.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 63.6 tp -115.94 93.26 4.18 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.906 0.384 . . . . 0.0 111.211 -175.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -134.81 88.69 27.13 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.429 173.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -66.79 135.06 36.98 Favored 'Trans proline' 0 C--O 1.233 0.258 0 C-N-CA 122.562 2.175 . . . . 0.0 112.042 -178.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.434 ' HB3' HG11 ' A' ' 40' ' ' VAL . 22.8 t -80.54 -80.02 0.14 Allowed 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.789 -0.448 . . . . 0.0 109.789 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.437 ' O ' HG13 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -135.56 -179.93 5.95 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.936 0.398 . . . . 0.0 111.085 177.466 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.504 ' HB2' HD12 ' A' ' 74' ' ' LEU . 6.6 m -114.91 139.18 50.0 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.742 -177.112 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.451 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 36.3 m-85 -119.97 132.07 55.38 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.672 -178.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.403 ' HG3' HG21 ' A' ' 72' ' ' VAL . 1.9 ptp180 -96.68 148.72 22.59 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.025 0.441 . . . . 0.0 110.052 176.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.507 HD11 ' HB2' ' A' ' 36' ' ' ALA . 22.1 mt -92.91 114.3 29.45 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.14 -178.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 17.8 p -85.05 -22.58 28.93 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.946 0.403 . . . . 0.0 110.443 176.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 161.95 -150.35 19.65 Favored Glycine 0 N--CA 1.441 -0.972 0 C-N-CA 120.41 -0.9 . . . . 0.0 112.094 177.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -106.59 164.69 11.86 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 -179.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.418 ' HB2' ' O ' ' A' ' 67' ' ' ALA . 33.1 t -52.44 131.73 44.19 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 123.435 0.46 . . . . 0.0 110.767 175.388 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_exo -66.35 -5.01 11.67 Favored 'Trans proline' 0 C--N 1.343 0.245 0 C-N-CA 122.843 2.362 . . . . 0.0 112.243 178.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -122.09 26.42 8.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.71 178.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 18.4 tt -72.03 151.96 8.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 177.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 26.5 t -130.39 160.04 35.19 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 120.976 0.417 . . . . 0.0 111.77 -171.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.6 m120 63.77 -105.55 0.15 Allowed 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.923 172.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -148.68 27.61 1.32 Allowed Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.017 -177.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -65.74 -27.75 68.54 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 7.1 ttm180 -56.75 -42.64 79.68 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.383 175.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -68.68 -34.56 75.87 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.579 -178.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.1 tpp180 -61.94 -47.86 83.01 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.296 0.57 . . . . 0.0 109.749 173.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 97.8 mt -66.38 -41.77 88.91 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.53 -177.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -59.39 -45.22 92.06 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.558 -0.747 . . . . 0.0 110.32 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 45.9 m -65.01 -34.36 78.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.746 179.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.9 ' HA ' ' HE1' ' A' ' 30' ' ' MET . 10.3 mmt -73.1 -19.99 61.03 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.079 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 105.81 9.91 31.69 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.556 -0.831 . . . . 0.0 112.132 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.614 HD13 HD13 ' A' ' 69' ' ' LEU . 93.0 mt -98.52 97.94 9.19 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 178.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.8 pp -143.85 160.82 48.76 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.624 -176.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -60.96 133.25 46.36 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.513 2.142 . . . . 0.0 111.677 178.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 113.88 -17.15 20.4 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.328 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.507 ' HB2' HD11 ' A' ' 12' ' ' ILE . . . -93.27 -178.22 4.69 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-O 121.274 0.559 . . . . 0.0 110.323 179.14 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -149.1 151.88 35.19 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.287 -177.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 71.3 mt -129.24 138.17 51.51 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.211 0.529 . . . . 0.0 110.612 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 34.6 ttm180 -98.01 116.07 29.48 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.129 175.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.53 ' HA ' HG11 ' A' ' 52' ' ' VAL . 7.9 p -67.01 128.16 29.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.222 0.534 . . . . 0.0 110.337 -178.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.88 HG11 ' HG3' ' A' ' 42' ' ' ARG . 46.8 t -98.91 -53.9 7.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.243 178.066 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.88 ' HG3' HG11 ' A' ' 41' ' ' VAL . 46.3 mtt180 -157.43 138.21 13.2 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -173.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.6 mp -112.35 106.61 21.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 157.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.508 ' HB2' ' HD3' ' A' ' 49' ' ' PRO . . . -53.16 128.89 49.53 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 120.582 0.23 . . . . 0.0 111.387 -173.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -61.25 -6.41 6.6 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 123.465 2.777 . . . . 0.0 112.666 -179.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.428 HD11 ' HA ' ' A' ' 46' ' ' LEU . 3.7 mm? -58.82 -34.53 71.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.343 172.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 164.9 -76.29 0.15 Allowed Glycine 0 CA--C 1.494 -1.235 0 N-CA-C 109.862 -1.295 . . . . 0.0 109.862 -175.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -176.19 119.92 0.3 Allowed Pre-proline 0 N--CA 1.449 -0.477 0 N-CA-C 114.266 1.21 . . . . 0.0 114.266 171.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.508 ' HD3' ' HB2' ' A' ' 44' ' ' ALA . 55.2 Cg_endo -115.47 166.32 0.03 OUTLIER 'Trans proline' 0 N--CA 1.438 -1.774 1 C-N-CA 125.736 4.291 . . . . 0.0 109.159 134.869 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.595 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 59.5 mt -116.84 100.32 10.09 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.703 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.979 179.708 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.469 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 35.8 mt-30 -92.74 115.38 28.06 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.423 179.605 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.53 HG11 ' HA ' ' A' ' 40' ' ' VAL . 19.8 m -131.53 171.92 17.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.486 -177.208 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -134.63 133.62 40.33 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 17.9 m -82.95 -73.02 0.42 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.779 0.323 . . . . 0.0 111.071 -177.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.477 ' HD2' ' O ' ' A' ' 55' ' ' ARG . 7.4 tmm_? -167.82 23.36 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.429 ' HB2' ' O ' ' A' ' 55' ' ' ARG . 8.4 tt0 171.59 -29.76 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.553 -175.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.5 t -130.24 143.93 51.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.146 -175.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 34.7 t -103.31 146.24 28.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.386 0.612 . . . . 0.0 110.762 -178.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.469 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 2.7 mm? -128.32 166.96 17.63 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.161 -178.496 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.595 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -149.39 133.94 17.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.85 179.129 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -151.59 174.34 13.56 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -175.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.475 ' HD2' ' N ' ' A' ' 62' ' ' ARG . 8.4 mpt_? -104.88 167.1 9.93 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 120.891 0.376 . . . . 0.0 111.363 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -43.98 -56.71 3.77 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 115.08 -0.964 . . . . 0.0 112.902 177.8 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -56.0 -40.12 72.89 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.272 0.558 . . . . 0.0 111.149 -176.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -70.76 -31.23 67.96 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.166 -176.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.439 HD13 HD12 ' A' ' 71' ' ' LEU . 18.2 tp -68.26 -39.49 82.18 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.295 176.408 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.418 ' O ' ' HB2' ' A' ' 16' ' ' SER . . . -63.91 -14.11 50.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.859 -177.556 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 83.8 mt -80.33 -16.49 54.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.985 0.421 . . . . 0.0 110.68 177.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.614 HD13 HD13 ' A' ' 32' ' ' LEU . 80.2 mt -109.2 151.35 26.6 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.018 176.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 26.3 m -107.5 114.26 28.15 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.351 0.596 . . . . 0.0 109.996 172.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.502 ' CD2' HG12 ' A' ' 12' ' ' ILE . 58.7 mt -122.45 137.48 54.86 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.162 -0.927 . . . . 0.0 110.335 -175.277 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.433 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 27.6 m -127.91 137.04 29.95 Favored Pre-proline 0 C--N 1.322 -0.605 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 174.746 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.451 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 13.6 Cg_exo -68.32 163.15 37.47 Favored 'Trans proline' 0 N--CA 1.463 -0.319 0 C-N-CA 122.124 1.883 . . . . 0.0 111.911 -178.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.504 HD12 ' HB2' ' A' ' 9' ' ' SER . 78.8 mt -79.43 -37.02 38.04 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.359 0.6 . . . . 0.0 110.156 175.078 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 29.7 t70 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.269 -0.872 . . . . 0.0 109.882 177.879 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.0 ptt? . . . . . 0 N--CA 1.478 0.943 0 N-CA-C 110.309 -0.256 . . . . 0.0 110.309 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 63.8 m 69.12 150.87 0.08 Allowed 'General case' 0 C--O 1.233 0.225 0 O-C-N 123.936 0.773 . . . . 0.0 111.769 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -109.51 96.23 6.14 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.784 -179.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 88.4 mt -88.8 -80.48 0.29 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.341 177.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 58.05 77.62 0.4 Allowed Pre-proline 0 N--CA 1.465 0.322 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.562 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.35 129.55 17.16 Favored 'Trans proline' 0 C--O 1.233 0.273 0 C-N-CA 122.53 2.153 . . . . 0.0 112.066 179.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 36.6 t -77.33 -68.13 0.65 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.548 178.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 53.5 mtp180 -135.44 161.49 35.32 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.046 0.451 . . . . 0.0 110.839 -176.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.5 ' HB2' HD12 ' A' ' 74' ' ' LEU . 19.8 m -118.51 141.83 48.19 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.796 179.011 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.475 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 4.6 m-85 -130.02 133.11 46.52 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.25 -174.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.583 ' HG2' ' HB1' ' A' ' 37' ' ' ALA . 55.7 mtt-85 -89.1 159.03 17.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.071 0.462 . . . . 0.0 110.751 177.092 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 40.0 mt -100.55 111.39 30.09 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.07 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.561 ' HG1' HG12 ' A' ' 72' ' ' VAL . 0.2 OUTLIER -77.24 -27.21 53.24 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.458 0.647 . . . . 0.0 110.256 179.345 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.551 ' HA2' ' HB3' ' A' ' 34' ' ' PRO . . . 153.61 -149.83 21.4 Favored Glycine 0 N--CA 1.441 -0.975 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.481 -177.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.592 ' CE1' ' HG3' ' A' ' 24' ' ' ARG . 19.5 m-85 -118.11 151.62 37.2 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 -179.307 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.525 ' O ' HG21 ' A' ' 19' ' ' ILE . 25.2 m -64.4 143.05 98.48 Favored Pre-proline 0 N--CA 1.447 -0.581 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 178.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 26.0 Cg_exo -62.69 -0.42 1.97 Allowed 'Trans proline' 0 CA--C 1.532 0.424 0 C-N-CA 123.268 2.646 . . . . 0.0 113.901 -173.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.75 -6.59 39.38 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.755 0.312 . . . . 0.0 111.463 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.525 HG21 ' O ' ' A' ' 16' ' ' SER . 12.7 tt -88.01 148.51 4.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 120.974 0.416 . . . . 0.0 110.647 -177.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.488 ' HB3' ' HD2' ' A' ' 23' ' ' TYR . 13.2 t -89.33 162.81 15.62 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.957 179.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -69.71 -40.59 76.17 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 -173.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.39 -33.94 86.43 Favored Glycine 0 CA--C 1.517 0.214 0 C-N-CA 120.422 -0.894 . . . . 0.0 112.037 177.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.488 ' HD2' ' HB3' ' A' ' 20' ' ' SER . 41.1 m-85 -67.15 -38.75 86.05 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 120.782 0.325 . . . . 0.0 110.319 175.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.592 ' HG3' ' CE1' ' A' ' 15' ' ' TYR . 20.2 ttm180 -59.24 -43.34 92.38 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.899 175.235 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -64.42 -37.14 86.5 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.368 -178.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 62.2 ttt180 -72.38 -36.53 68.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.207 178.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.407 HD23 ' CE ' ' A' ' 30' ' ' MET . 73.8 mt -68.76 -43.37 75.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.411 179.038 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -58.78 -45.39 89.92 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.92 178.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 64.9 m -64.32 -31.6 72.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.588 179.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.407 ' CE ' HD23 ' A' ' 27' ' ' LEU . 71.7 mtm -81.33 -15.11 56.34 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.692 -179.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 116.96 6.92 13.43 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.406 -0.902 . . . . 0.0 113.611 174.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.4 mt -105.42 98.02 7.78 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 178.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -128.95 150.76 76.14 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.258 -174.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.551 ' HB3' ' HA2' ' A' ' 14' ' ' GLY . 37.9 Cg_endo -66.23 135.01 38.46 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.807 2.338 . . . . 0.0 111.534 178.39 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 107.16 -19.73 34.3 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.332 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.32 -171.41 3.56 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-O 121.327 0.584 . . . . 0.0 110.57 -178.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.583 ' HB1' ' HG2' ' A' ' 11' ' ' ARG . . . -148.22 135.9 20.76 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.287 -177.13 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.462 HD11 HG21 ' A' ' 52' ' ' VAL . 51.0 mt -108.8 131.88 54.54 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.159 0.504 . . . . 0.0 110.523 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 6.4 ttp85 -101.94 123.43 45.85 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.321 -0.854 . . . . 0.0 108.831 175.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.566 ' HA ' HG11 ' A' ' 52' ' ' VAL . 10.8 p -69.13 127.2 30.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 121.405 0.622 . . . . 0.0 111.391 -175.308 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.5 t -88.44 -50.64 13.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.761 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.927 174.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 38.9 ttm180 -175.18 142.97 0.65 Allowed 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.192 0.52 . . . . 0.0 112.033 -178.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 98.0 mt -100.86 140.57 19.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 168.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.707 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -82.64 147.93 56.86 Favored Pre-proline 0 C--N 1.324 -0.528 0 O-C-N 122.247 -0.283 . . . . 0.0 111.087 -178.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -67.18 -2.05 7.37 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 123.25 2.633 . . . . 0.0 112.915 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.429 HD22 ' HA ' ' A' ' 46' ' ' LEU . 1.0 OUTLIER -56.57 -38.92 72.63 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 122.153 0.978 . . . . 0.0 109.448 174.921 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.544 ' O ' ' HB2' ' A' ' 48' ' ' ASP . . . 153.18 -55.0 0.44 Allowed Glycine 0 N--CA 1.434 -1.489 0 N-CA-C 108.289 -1.924 . . . . 0.0 108.289 -170.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.544 ' HB2' ' O ' ' A' ' 47' ' ' GLY . 13.0 t70 169.24 120.31 0.04 OUTLIER Pre-proline 0 N--CA 1.452 -0.373 0 O-C-N 125.155 1.15 . . . . 0.0 113.075 168.318 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.707 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 27.8 Cg_endo -109.94 163.53 0.07 OUTLIER 'Trans proline' 0 N--CA 1.433 -2.038 1 C-N-CA 125.307 4.005 . . . . 0.0 108.097 137.324 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.782 HG23 HG13 ' A' ' 52' ' ' VAL . 30.8 mt -115.87 103.97 16.02 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 C-N-CA 119.31 -0.956 . . . . 0.0 110.672 -177.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.46 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 97.9 mt-30 -84.63 113.17 21.08 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 173.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.782 HG13 HG23 ' A' ' 50' ' ' ILE . 15.5 m -132.98 165.68 31.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 120.887 0.375 . . . . 0.0 111.481 -177.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -147.26 141.04 25.72 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.523 -0.918 . . . . 0.0 108.523 176.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 8.9 t -95.89 -47.7 6.03 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.169 -0.612 . . . . 0.0 109.699 176.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 55' ' ' ARG . 13.9 ptt180 177.24 24.04 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.474 0.71 . . . . 0.0 109.554 175.105 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -127.32 -65.71 0.92 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.082 -172.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.3 t -164.47 153.73 13.47 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.052 -178.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 10.5 m -71.89 141.39 49.54 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.135 0.493 . . . . 0.0 111.139 -179.415 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.46 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 65.8 tp -139.9 144.6 37.23 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.031 178.177 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.408 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -112.56 141.39 46.38 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.605 179.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.577 HD12 HD13 ' A' ' 50' ' ' ILE . 4.0 pp -142.29 161.43 38.05 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 -179.208 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.661 ' HD3' ' OD2' ' A' ' 65' ' ' ASP . 2.8 mpt_? -96.75 175.37 6.39 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.005 0.431 . . . . 0.0 109.979 -177.22 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.1 mmt180 -66.2 -33.52 75.95 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.508 177.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -66.87 -35.3 79.7 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.664 177.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.661 ' OD2' ' HD3' ' A' ' 62' ' ' ARG . 41.4 m-20 -68.23 -42.5 79.64 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-O 121.422 0.629 . . . . 0.0 109.366 175.111 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 45.5 tp -60.21 -32.37 71.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.875 178.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.84 -21.57 66.48 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.453 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 89.6 mt -86.03 -18.61 32.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.92 0.39 . . . . 0.0 110.996 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 88.7 mt -104.39 141.85 35.61 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.709 -177.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 20.2 m -101.29 115.67 31.03 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 172.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 73.2 mt -117.83 147.69 42.81 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.246 -176.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.561 HG12 ' HG1' ' A' ' 13' ' ' THR . 4.6 m -128.26 115.33 20.02 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.645 172.287 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.475 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 21.9 Cg_exo -65.31 161.62 36.94 Favored 'Trans proline' 0 N--CA 1.464 -0.251 0 C-N-CA 122.134 1.889 . . . . 0.0 112.323 -177.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.519 HD21 ' HG3' ' A' ' 11' ' ' ARG . 97.6 mt -93.56 -15.48 25.4 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 121.341 0.591 . . . . 0.0 109.705 176.413 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.4 t70 . . . . . 0 C--O 1.244 0.809 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.407 176.739 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.5 mtt . . . . . 0 N--CA 1.482 1.13 0 CA-C-O 120.685 0.279 . . . . 0.0 110.41 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.6 p -177.71 35.66 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.135 -178.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.52 72.76 6.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.346 -175.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.7 pp -162.47 159.16 24.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.147 0.499 . . . . 0.0 111.229 178.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -151.85 77.01 7.17 Favored Pre-proline 0 C--N 1.322 -0.608 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 177.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -83.89 149.13 12.36 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 122.478 2.119 . . . . 0.0 112.069 -178.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.6 t -166.16 -61.76 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.868 0.366 . . . . 0.0 111.079 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -103.71 173.21 6.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.621 0.724 . . . . 0.0 112.057 -172.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.434 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 13.4 t -137.92 140.42 40.3 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.66 172.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -123.87 129.11 50.47 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.261 -175.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.42 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 36.3 mtt-85 -88.96 146.84 24.64 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 177.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.505 HG12 ' CD2' ' A' ' 71' ' ' LEU . 36.7 mt -90.91 111.59 23.88 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 175.429 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 18.5 m -79.08 -22.24 45.58 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.341 0.591 . . . . 0.0 110.336 178.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.648 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 156.94 -142.78 8.96 Favored Glycine 0 N--CA 1.443 -0.873 0 C-N-CA 120.834 -0.698 . . . . 0.0 111.785 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.519 ' HB3' HG22 ' A' ' 19' ' ' ILE . 34.0 m-85 -121.82 151.16 40.92 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.629 ' O ' HG21 ' A' ' 19' ' ' ILE . 74.3 p -69.59 159.16 84.89 Favored Pre-proline 0 N--CA 1.445 -0.68 0 CA-C-O 120.683 0.278 . . . . 0.0 111.002 -177.226 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_exo -73.44 11.57 0.99 Allowed 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 122.533 2.155 . . . . 0.0 111.961 174.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.415 ' H ' ' C ' ' A' ' 16' ' ' SER . . . -103.77 -14.26 16.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.766 179.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.629 HG21 ' O ' ' A' ' 16' ' ' SER . 13.0 tt -89.43 142.96 12.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 120.77 0.319 . . . . 0.0 110.166 179.572 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.7 t -161.36 -174.69 4.41 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.624 0.25 . . . . 0.0 110.368 -174.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.1 t30 59.15 34.91 23.49 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.284 0.634 . . . . 0.0 111.793 174.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.39 6.0 87.84 Favored Glycine 0 CA--C 1.519 0.293 0 C-N-CA 120.838 -0.696 . . . . 0.0 114.011 174.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -62.22 -22.83 66.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 117.31 0.555 . . . . 0.0 110.889 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.477 ' HG2' ' CG ' ' A' ' 15' ' ' TYR . 34.6 mtt85 -63.95 -42.84 97.18 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.746 174.655 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -66.88 -35.79 80.83 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 121.231 0.539 . . . . 0.0 109.802 177.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 86.1 mtt180 -62.13 -44.14 97.28 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.814 176.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.604 HD21 HD12 ' A' ' 32' ' ' LEU . 38.2 mt -69.56 -41.71 75.5 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.493 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -58.14 -47.44 83.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.415 178.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 59.3 m -63.34 -28.68 70.17 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.571 -179.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 67.9 mtm -84.71 -12.99 52.68 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.424 178.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 114.76 -0.28 23.1 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.471 -0.871 . . . . 0.0 113.261 174.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.799 HD11 HD13 ' A' ' 69' ' ' LEU . 88.7 mt -96.05 100.44 12.1 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.968 0.413 . . . . 0.0 110.107 -178.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 pp -138.89 155.42 73.09 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.069 -175.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.648 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 23.0 Cg_exo -64.4 137.61 56.39 Favored 'Trans proline' 0 C--O 1.234 0.308 0 C-N-CA 122.9 2.4 . . . . 0.0 112.052 179.528 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 111.04 -28.12 10.14 Favored Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.313 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.03 154.08 21.04 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-O 121.122 0.486 . . . . 0.0 110.105 -179.041 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.42 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -129.94 138.17 50.74 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.973 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.632 ' HB3' ' HB ' ' A' ' 52' ' ' VAL . 2.2 mm? -106.87 142.19 36.9 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.268 179.803 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 35.5 ttt180 -94.16 132.85 38.28 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 173.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.564 ' HA ' HG13 ' A' ' 52' ' ' VAL . 7.6 p -71.64 128.28 34.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.157 0.504 . . . . 0.0 111.084 -175.597 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.0 t -99.35 -44.87 11.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.611 176.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 57.9 ttt180 -176.52 135.79 0.25 Allowed 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 -177.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.8 mp -116.6 128.76 73.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 166.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.12 125.49 91.05 Favored Pre-proline 0 C--N 1.32 -0.675 0 C-N-CA 121.048 -0.261 . . . . 0.0 110.442 176.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -57.36 -14.45 15.98 Favored 'Trans proline' 0 N--CA 1.475 0.428 0 C-N-CA 123.426 2.751 . . . . 0.0 113.107 -179.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 46' ' ' LEU . 3.9 mm? -54.92 -33.24 61.95 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.315 176.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 164.37 -75.64 0.16 Allowed Glycine 0 N--CA 1.435 -1.419 0 N-CA-C 110.981 -0.848 . . . . 0.0 110.981 -177.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -164.68 118.53 0.99 Allowed Pre-proline 0 N--CA 1.443 -0.818 0 N-CA-C 114.522 1.304 . . . . 0.0 114.522 179.364 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -118.61 -175.5 0.02 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.714 1 C-N-CA 126.994 5.129 . . . . 0.0 107.988 132.738 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.5 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 67.3 mt -145.11 104.43 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.237 0 C-N-CA 120.117 -0.633 . . . . 0.0 109.882 173.253 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.44 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 8.9 tt0 -92.96 120.64 33.49 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 174.233 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.632 ' HB ' ' HB3' ' A' ' 38' ' ' LEU . 7.6 m -140.53 162.02 23.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.777 0.322 . . . . 0.0 111.025 -176.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -119.12 135.61 54.57 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.024 -0.534 . . . . 0.0 109.689 -178.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.0 t -88.91 -33.12 17.4 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.704 -0.399 . . . . 0.0 110.044 179.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 35.1 ttm180 178.24 -61.25 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.308 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -107.31 -38.33 5.99 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.513 178.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.0 t -109.0 150.2 28.1 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.901 0.381 . . . . 0.0 110.845 -174.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.2 p -114.38 144.91 42.53 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.649 179.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.44 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 6.2 mp -127.45 162.01 27.38 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.987 -176.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.5 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -131.41 142.18 49.98 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.858 177.097 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.471 HD12 ' HB2' ' A' ' 65' ' ' ASP . 3.9 pp -153.82 177.34 11.11 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 -174.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.402 ' HD2' ' O ' ' A' ' 61' ' ' LEU . 15.1 mmm-85 -121.92 -175.04 3.02 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.931 0.872 . . . . 0.0 111.521 -178.673 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.0 ptp180 -56.04 -34.0 65.47 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 113.757 -1.565 . . . . 0.0 111.669 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -63.11 -44.61 95.15 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.478 179.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.471 ' HB2' HD12 ' A' ' 61' ' ' LEU . 7.7 m-20 -67.63 -39.45 84.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.246 0.546 . . . . 0.0 109.601 178.122 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 66.3 tp -60.03 -39.64 86.58 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.289 -0.868 . . . . 0.0 110.878 177.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.45 -12.84 61.61 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.231 -0.441 . . . . 0.0 112.118 -176.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.477 ' HB3' HD11 ' A' ' 19' ' ' ILE . 93.8 mt -93.32 -21.33 19.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.79 0.329 . . . . 0.0 110.81 179.459 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.799 HD13 HD11 ' A' ' 32' ' ' LEU . 96.9 mt -107.25 140.32 40.32 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.463 -175.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.5 m -91.27 112.29 24.14 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 169.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.505 ' CD2' HG12 ' A' ' 12' ' ' ILE . 82.6 mt -120.92 128.05 52.41 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.307 -174.485 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.409 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 34.9 m -124.93 133.03 24.45 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.119 176.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 72' ' ' VAL . 18.5 Cg_exo -65.04 163.29 29.2 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.087 1.858 . . . . 0.0 111.414 179.223 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 9' ' ' SER . 91.3 mt -53.81 -57.62 10.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.216 0.531 . . . . 0.0 109.714 173.562 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.6 t70 . . . . . 0 C--O 1.251 1.132 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.416 176.413 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.8 tpt . . . . . 0 N--CA 1.483 1.201 0 CA-C-O 120.764 0.316 . . . . 0.0 110.355 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.5 m -117.3 113.64 22.44 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.351 179.054 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -86.74 156.5 19.91 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.588 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.8 tt 61.64 98.28 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.365 0 O-C-N 123.928 0.767 . . . . 0.0 110.263 -176.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -125.66 125.39 24.97 Favored Pre-proline 0 C--N 1.321 -0.674 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.473 -179.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -62.9 118.89 5.79 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 122.443 2.095 . . . . 0.0 110.655 175.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.0 t -106.93 -63.07 1.32 Allowed 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.597 -170.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 47.8 ttt85 -111.12 144.57 40.05 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.56 -171.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.1 t -123.21 139.78 53.7 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.925 -178.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.625 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 8.3 m-85 -116.66 133.19 56.31 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -178.307 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.453 ' CZ ' HD21 ' A' ' 74' ' ' LEU . 11.2 ptp180 -102.73 157.91 16.62 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 175.654 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.479 HG12 ' CD2' ' A' ' 71' ' ' LEU . 19.6 mt -104.66 115.04 45.81 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.131 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.018 -178.381 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 1.5 p -93.05 -16.27 25.19 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.664 0.269 . . . . 0.0 111.255 178.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.534 ' HA2' ' HB3' ' A' ' 34' ' ' PRO . . . 165.13 -153.84 24.24 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.487 -0.863 . . . . 0.0 112.28 178.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.503 ' CE1' ' HD3' ' A' ' 34' ' ' PRO . 60.9 m-85 -119.86 153.32 36.0 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 -178.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.591 ' O ' HG21 ' A' ' 19' ' ' ILE . 29.2 m -67.89 138.47 92.85 Favored Pre-proline 0 N--CA 1.441 -0.875 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 176.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -65.98 6.82 0.42 Allowed 'Trans proline' 0 CA--C 1.532 0.415 0 C-N-CA 122.771 2.314 . . . . 0.0 113.481 -175.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.41 ' H ' ' C ' ' A' ' 16' ' ' SER . . . -106.39 7.77 31.29 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.705 179.053 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.591 HG21 ' O ' ' A' ' 16' ' ' SER . 13.5 tt -96.97 132.87 40.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 CA-C-O 121.034 0.445 . . . . 0.0 110.464 177.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.9 t -156.75 -161.54 1.11 Allowed 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 -176.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 67.51 16.55 9.96 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.652 0.739 . . . . 0.0 110.924 175.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 79.69 4.05 89.23 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.51 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -66.11 -27.67 68.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.223 0.535 . . . . 0.0 110.245 -178.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 27.4 ttm180 -64.02 -41.95 97.27 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.023 176.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -69.69 -32.86 71.71 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.508 177.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -64.08 -43.33 95.75 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.997 0.427 . . . . 0.0 109.969 175.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.543 HD21 HD11 ' A' ' 32' ' ' LEU . 57.8 mt -64.3 -45.69 86.87 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.092 176.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -56.69 -45.33 81.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.417 178.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 48.8 m -63.19 -33.38 75.34 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.048 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 71.5 mtm -81.79 -10.44 59.34 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.434 -179.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 108.1 5.0 33.2 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.661 -0.78 . . . . 0.0 113.138 174.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.576 HD13 HD11 ' A' ' 69' ' ' LEU . 97.5 mt -94.0 91.0 6.66 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 177.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.8 pp -135.75 157.85 75.32 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.336 -174.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.534 ' HB3' ' HA2' ' A' ' 14' ' ' GLY . 32.3 Cg_endo -65.69 124.01 12.18 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.698 2.265 . . . . 0.0 111.627 177.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.56 -7.41 17.95 Favored Glycine 0 N--CA 1.444 -0.819 0 C-N-CA 120.818 -0.706 . . . . 0.0 111.843 -176.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.4 ' HB2' HD11 ' A' ' 12' ' ' ILE . . . -97.27 -172.52 2.44 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-O 120.985 0.422 . . . . 0.0 110.553 178.189 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.444 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -160.13 149.71 17.86 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.654 -176.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 58.8 mt -125.22 138.53 54.12 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.781 178.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 36.9 ttp180 -111.5 124.22 51.84 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 176.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.526 ' HA ' HG12 ' A' ' 52' ' ' VAL . 7.4 p -61.58 127.79 21.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-O 121.109 0.481 . . . . 0.0 112.11 -174.458 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 92.7 t -102.71 -50.9 9.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.917 171.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.9 ptm180 -170.67 161.05 7.37 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.122 0.487 . . . . 0.0 111.785 -178.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 82.5 mt -135.1 143.19 37.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 171.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.673 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -69.13 142.34 92.78 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 117.88 0.309 . . . . 0.0 110.841 179.065 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 22.7 Cg_exo -66.06 -8.92 21.52 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 123.184 2.589 . . . . 0.0 113.25 -177.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.409 HD13 ' HA ' ' A' ' 46' ' ' LEU . 4.0 mm? -65.86 -88.48 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.643 0.735 . . . . 0.0 110.443 176.644 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -123.95 -74.53 0.27 Allowed Glycine 0 CA--C 1.491 -1.444 0 N-CA-C 109.425 -1.47 . . . . 0.0 109.425 172.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.449 ' OD2' ' HB3' ' A' ' 63' ' ' ARG . 4.9 p-10 -178.44 124.41 0.26 Allowed Pre-proline 0 N--CA 1.44 -0.955 0 N-CA-C 113.995 1.109 . . . . 0.0 113.995 174.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.673 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 15.1 Cg_endo -105.45 157.82 0.16 Allowed 'Trans proline' 0 N--CA 1.437 -1.812 0 C-N-CA 125.005 3.803 . . . . 0.0 107.458 136.539 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.605 HG21 HG11 ' A' ' 52' ' ' VAL . 4.5 mp -119.8 104.88 16.29 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.706 0 C-N-CA 118.988 -1.085 . . . . 0.0 110.365 -175.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.439 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 26.1 mp0 -88.65 117.85 27.9 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.078 174.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.605 HG11 HG21 ' A' ' 50' ' ' ILE . 14.1 m -132.94 172.44 16.46 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.51 -178.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.5 ' HG2' ' H ' ' A' ' 55' ' ' ARG . 34.0 tt0 -117.58 130.83 56.64 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.004 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 17.8 p -92.53 17.89 9.41 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.088 -179.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.5 ' H ' ' HG2' ' A' ' 53' ' ' GLU . 0.0 OUTLIER 63.32 21.09 12.63 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.818 0.818 . . . . 0.0 109.005 -173.935 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -141.72 -62.37 0.46 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.993 -1.003 . . . . 0.0 108.512 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.7 t -142.92 174.72 10.42 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.679 178.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 17.8 m -82.49 143.45 31.11 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.99 0.424 . . . . 0.0 110.331 178.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.439 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 43.8 tp -134.14 144.62 48.65 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.572 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.534 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -133.07 139.72 47.3 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.74 -0.663 . . . . 0.0 109.574 177.604 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.0 pp -154.84 178.81 9.73 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -176.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 25.6 mmt85 -115.73 170.55 8.37 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 121.92 0.866 . . . . 0.0 112.206 -178.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.449 ' HB3' ' OD2' ' A' ' 48' ' ' ASP . 13.1 ptt-85 -62.14 -36.15 80.91 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 113.611 -1.631 . . . . 0.0 111.766 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.425 ' HE3' ' HB3' ' A' ' 64' ' ' LYS . 1.3 tmmt? -58.16 -45.85 86.74 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.923 0.392 . . . . 0.0 110.624 178.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -71.74 -37.75 70.52 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.324 0.583 . . . . 0.0 110.137 178.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 18.7 tp -64.12 -33.25 75.34 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.78 -179.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.27 -18.37 63.13 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.777 -178.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.414 ' HB3' HD12 ' A' ' 19' ' ' ILE . 91.2 mt -88.76 -7.49 56.14 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.757 0.313 . . . . 0.0 110.959 -179.701 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.576 HD11 HD13 ' A' ' 32' ' ' LEU . 94.7 mt -103.49 141.75 35.46 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.545 178.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 25.1 m -96.77 114.52 26.16 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 172.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.479 ' CD2' HG12 ' A' ' 12' ' ' ILE . 74.5 mt -121.79 134.98 54.91 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.047 -172.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.448 ' O ' ' HG2' ' A' ' 11' ' ' ARG . 17.1 m -127.61 128.48 23.94 Favored Pre-proline 0 C--N 1.319 -0.725 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 170.573 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.625 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 36.9 Cg_endo -65.63 163.4 30.36 Favored 'Trans proline' 0 C--O 1.234 0.29 0 C-N-CA 122.526 2.151 . . . . 0.0 113.545 -173.231 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.453 HD21 ' CZ ' ' A' ' 11' ' ' ARG . 95.7 mt -94.63 -71.77 0.65 Allowed 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.292 -0.867 . . . . 0.0 108.708 173.125 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 . . . . . 0 C--O 1.253 1.249 0 CA-C-O 117.748 -1.12 . . . . 0.0 109.304 175.603 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.8 mtm . . . . . 0 N--CA 1.481 1.087 0 CA-C-O 120.837 0.351 . . . . 0.0 110.775 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.9 p -144.28 104.59 4.12 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.589 175.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -80.76 76.73 7.65 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.239 -171.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -161.42 140.99 10.33 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.312 172.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -138.67 91.6 11.96 Favored Pre-proline 0 C--N 1.319 -0.747 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 176.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.589 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 19.1 Cg_exo -66.53 126.99 16.4 Favored 'Trans proline' 0 N--CA 1.461 -0.432 0 C-N-CA 122.956 2.437 . . . . 0.0 112.276 -177.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 23.4 t -79.43 -66.37 0.88 Allowed 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 176.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 88.3 mtt180 -149.34 153.47 37.5 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 120.857 0.36 . . . . 0.0 110.775 177.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.484 ' HB2' HD12 ' A' ' 74' ' ' LEU . 2.2 m -95.79 135.56 37.35 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.921 179.414 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.515 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 44.8 m-85 -113.97 141.09 47.83 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.213 -177.712 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.534 ' HD2' HD21 ' A' ' 74' ' ' LEU . 45.4 mtp180 -97.96 144.94 26.98 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 178.652 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.427 HG12 ' CD2' ' A' ' 71' ' ' LEU . 18.7 mt -99.02 113.67 34.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 177.235 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 12.6 p -102.0 -3.63 27.4 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -175.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.486 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 160.46 -161.73 32.84 Favored Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 119.946 -1.121 . . . . 0.0 112.445 175.541 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -118.93 156.61 29.25 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.403 ' O ' HG22 ' A' ' 19' ' ' ILE . 36.9 t -66.1 137.36 95.74 Favored Pre-proline 0 C--N 1.319 -0.726 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 170.496 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -59.22 -14.81 25.77 Favored 'Trans proline' 0 CA--C 1.529 0.272 0 C-N-CA 122.838 2.359 . . . . 0.0 112.867 -176.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -78.3 -8.59 58.57 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.746 -178.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.403 HG22 ' O ' ' A' ' 16' ' ' SER . 15.7 tt -63.16 129.12 26.29 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-O 121.163 0.506 . . . . 0.0 110.523 179.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.3 t -134.21 178.16 7.19 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.318 -172.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 58.58 -158.99 0.29 Allowed 'General case' 0 CA--C 1.534 0.352 0 O-C-N 123.651 0.594 . . . . 0.0 109.59 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -94.09 25.62 21.11 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.817 -0.706 . . . . 0.0 111.782 176.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.433 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 4.9 t80 -64.48 -32.3 73.87 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.024 0.44 . . . . 0.0 110.154 -177.483 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 14.4 ttm180 -58.9 -42.11 88.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.464 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -65.61 -39.73 91.85 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.409 -179.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 34.1 ttt180 -66.17 -39.49 89.79 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.972 178.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 23' ' ' TYR . 85.2 mt -66.83 -44.3 81.44 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.349 179.298 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -57.62 -44.75 85.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.115 177.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 47.2 m -63.21 -34.17 77.06 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.172 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.898 ' HE2' ' HA ' ' A' ' 30' ' ' MET . 15.9 mmt -74.34 -24.67 59.22 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.848 -179.667 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.06 6.04 14.35 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.498 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.66 HD13 HD13 ' A' ' 69' ' ' LEU . 68.7 mt -97.66 90.86 5.15 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.2 pp -141.29 155.15 67.95 Favored Pre-proline 0 C--N 1.322 -0.604 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.065 -174.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.486 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 24.0 Cg_exo -63.72 127.05 18.71 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.815 2.343 . . . . 0.0 111.931 178.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.64 5.67 44.86 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.081 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -107.52 -179.45 3.92 Favored 'General case' 0 N--CA 1.442 -0.853 0 CA-C-O 120.968 0.413 . . . . 0.0 109.957 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -148.55 145.59 27.92 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.093 -177.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.462 HD13 HG21 ' A' ' 52' ' ' VAL . 45.6 mt -129.39 131.12 46.74 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.45 177.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.462 ' HA ' ' HA ' ' A' ' 9' ' ' SER . 38.3 ttm180 -100.61 118.84 37.58 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.222 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.589 ' O ' ' HA ' ' A' ' 6' ' ' PRO . 7.5 p -65.32 131.09 31.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.56 0.695 . . . . 0.0 111.506 -174.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.733 HG13 ' HG3' ' A' ' 42' ' ' ARG . 59.2 t -95.84 -54.97 6.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.942 174.111 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.733 ' HG3' HG13 ' A' ' 41' ' ' VAL . 54.9 mtp180 -155.23 143.49 20.24 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -176.168 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.7 mp -114.87 119.43 61.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 161.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.405 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -56.91 127.87 75.77 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-O 120.525 0.202 . . . . 0.0 111.129 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 38.4 Cg_exo -62.33 -8.56 12.83 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 123.415 2.743 . . . . 0.0 112.61 -179.18 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -56.24 -38.36 70.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.554 173.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 170.52 -77.01 0.1 OUTLIER Glycine 0 N--CA 1.438 -1.172 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 -176.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -169.85 120.74 0.58 Allowed Pre-proline 0 N--CA 1.452 -0.361 0 CA-C-O 122.257 1.027 . . . . 0.0 113.666 177.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -117.96 -166.79 0.01 OUTLIER 'Trans proline' 0 N--CA 1.438 -1.786 1 C-N-CA 126.337 4.691 . . . . 0.0 107.777 139.206 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.687 HG21 HG12 ' A' ' 52' ' ' VAL . 54.5 mt -143.8 101.9 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.239 0 C-N-CA 120.255 -0.578 . . . . 0.0 109.628 168.124 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.496 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 54.2 mt-30 -87.91 119.09 27.93 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 175.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.687 HG12 HG21 ' A' ' 50' ' ' ILE . 17.7 m -132.68 171.88 17.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 120.802 0.335 . . . . 0.0 111.56 -175.379 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.443 ' HG3' ' H ' ' A' ' 55' ' ' ARG . 10.1 tp10 -138.82 141.19 38.71 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 176.201 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.1 t -124.13 18.53 9.16 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.639 0.733 . . . . 0.0 109.644 -176.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.443 ' H ' ' HG3' ' A' ' 53' ' ' GLU . 74.6 mtm180 74.52 23.7 1.87 Allowed 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.66 178.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -140.91 -52.92 0.47 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.275 0.56 . . . . 0.0 110.062 -178.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 59.9 m -153.84 135.67 14.54 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.472 -0.785 . . . . 0.0 109.428 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.5 m -76.65 131.52 38.89 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 175.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.496 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 3.0 mm? -121.64 171.75 8.61 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.98 0.419 . . . . 0.0 111.495 -176.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.537 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -146.25 141.79 27.72 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 174.172 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.45 ' C ' ' HD2' ' A' ' 62' ' ' ARG . 4.1 pp -146.18 155.45 42.72 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 120.693 -0.403 . . . . 0.0 110.167 -173.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.592 ' HD2' ' N ' ' A' ' 62' ' ' ARG . 4.2 mpt_? -104.39 164.79 11.49 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.585 -178.085 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 45.5 mtm180 -50.76 -36.05 34.8 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 114.858 -1.065 . . . . 0.0 112.925 -178.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -59.19 -49.33 78.26 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.761 0.315 . . . . 0.0 110.824 178.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -72.39 -34.37 67.88 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.035 0.445 . . . . 0.0 110.194 178.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 62.6 tp -62.71 -37.05 84.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.005 178.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.71 -18.56 65.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.731 -178.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 96.0 mt -94.77 -4.59 47.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.566 -178.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.66 HD13 HD13 ' A' ' 32' ' ' LEU . 92.1 mt -111.5 129.24 56.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.778 0.323 . . . . 0.0 111.521 -176.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.9 m -88.55 115.95 26.44 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 172.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.427 ' CD2' HG12 ' A' ' 12' ' ' ILE . 70.5 mt -124.93 135.33 52.74 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.021 -174.489 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 24.1 m -133.76 132.64 21.7 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.455 173.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.515 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 17.1 Cg_exo -66.07 164.05 29.06 Favored 'Trans proline' 0 CA--C 1.533 0.427 0 C-N-CA 122.48 2.12 . . . . 0.0 113.196 -175.398 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.534 HD21 ' HD2' ' A' ' 11' ' ' ARG . 39.2 mt -67.69 -26.32 66.12 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.207 175.631 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 37.1 t70 . . . . . 0 C--O 1.248 1.001 0 O-C-N 124.102 0.876 . . . . 0.0 110.707 -178.186 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 49.2 ttm . . . . . 0 N--CA 1.478 0.937 0 CA-C-O 121.161 0.505 . . . . 0.0 109.991 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.5 m -127.34 119.21 25.71 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.437 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -86.31 111.74 20.75 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.958 0.409 . . . . 0.0 111.345 -177.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.777 HD23 ' HG2' ' A' ' 42' ' ' ARG . 9.9 mp -88.54 137.86 31.94 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 175.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.422 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 73.4 mt-30 -82.86 128.35 66.14 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.675 -176.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.446 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 31.5 Cg_exo -61.17 123.98 13.93 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 122.826 2.351 . . . . 0.0 111.788 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.2 t -104.18 -77.04 0.58 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.825 -173.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -95.93 169.95 9.63 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.441 0.639 . . . . 0.0 111.78 -175.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.488 ' HB3' HD11 ' A' ' 74' ' ' LEU . 23.4 t -140.29 140.28 35.66 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 114.994 -1.003 . . . . 0.0 109.483 176.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.562 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 15.0 m-85 -121.14 128.33 52.43 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 -178.17 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.464 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 67.6 mtp180 -97.81 149.87 21.88 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.515 178.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 25.5 mt -88.08 117.2 31.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 8.8 t -94.8 -18.47 21.2 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.944 0.402 . . . . 0.0 110.271 -179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 166.89 -161.66 35.46 Favored Glycine 0 N--CA 1.443 -0.849 0 C-N-CA 120.449 -0.881 . . . . 0.0 112.269 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -105.81 158.35 16.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.677 0.275 . . . . 0.0 110.446 -178.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.445 ' O ' HG23 ' A' ' 19' ' ' ILE . 31.3 t -52.05 134.24 39.69 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.945 175.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 17.7 Cg_exo -67.77 2.53 2.44 Favored 'Trans proline' 0 C--O 1.235 0.374 0 C-N-CA 122.954 2.436 . . . . 0.0 112.649 178.5 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -115.52 6.7 14.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.916 178.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.445 HG23 ' O ' ' A' ' 16' ' ' SER . 10.8 tt -87.9 150.48 3.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.908 0.385 . . . . 0.0 110.812 -177.831 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 35.4 t -89.67 158.69 17.47 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.156 178.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.462 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 15.0 m120 -54.95 -44.3 74.2 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.237 -179.237 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.1 -36.67 92.22 Favored Glycine 0 C--N 1.329 0.173 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.833 -176.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -72.71 -31.19 64.82 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.43 ' HB3' ' O ' ' A' ' 21' ' ' ASN . 12.8 ttt180 -62.0 -43.79 98.1 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.746 172.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.462 ' HG3' ' O ' ' A' ' 21' ' ' ASN . 28.1 mt-30 -61.1 -41.88 97.48 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.565 177.182 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -57.83 -48.53 79.51 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.326 175.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.512 HD21 HD11 ' A' ' 32' ' ' LEU . 41.2 mt -67.55 -40.15 84.99 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.682 -176.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -60.34 -46.14 90.95 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.026 178.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 46.1 m -65.99 -31.49 72.42 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.141 179.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 82.5 mtp -71.03 -24.52 62.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.536 177.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 112.39 6.54 23.62 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.89 -0.671 . . . . 0.0 112.184 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.579 HD13 HD12 ' A' ' 69' ' ' LEU . 85.8 mt -98.31 97.3 8.69 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.989 0.423 . . . . 0.0 110.051 -178.272 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.4 pp -142.06 157.6 63.5 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.871 -176.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.66 139.38 88.59 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.731 2.287 . . . . 0.0 112.357 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 112.07 -21.07 20.87 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.328 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -85.53 -177.51 6.45 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 121.048 0.452 . . . . 0.0 110.35 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.464 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -159.65 134.93 8.22 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.91 -176.369 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.45 ' N ' HD22 ' A' ' 38' ' ' LEU . 2.2 mm? -108.55 141.18 40.85 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.622 176.486 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.412 ' HG2' ' HB3' ' A' ' 6' ' ' PRO . 20.5 ttm180 -109.09 127.72 54.38 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 176.656 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.537 ' HA ' HG11 ' A' ' 52' ' ' VAL . 9.9 p -67.27 127.71 29.29 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-O 121.309 0.576 . . . . 0.0 111.662 -172.6 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.8 t -106.73 -50.68 7.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.703 173.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.777 ' HG2' HD23 ' A' ' 4' ' ' LEU . 1.1 mtp180 -156.92 159.66 38.34 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -174.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 80.0 mt -127.45 142.53 43.33 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 162.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.596 ' H ' ' CD ' ' A' ' 49' ' ' PRO . . . -84.14 140.27 39.65 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-O 120.554 0.216 . . . . 0.0 111.523 -177.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -65.8 -7.39 16.5 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 123.107 2.538 . . . . 0.0 112.152 176.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.545 HD11 ' HB1' ' A' ' 44' ' ' ALA . 10.0 mp -57.76 -28.82 64.29 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.752 0.787 . . . . 0.0 110.336 173.36 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 153.95 -76.97 0.21 Allowed Glycine 0 N--CA 1.432 -1.633 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 -175.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -170.92 124.2 0.59 Allowed Pre-proline 0 N--CA 1.435 -1.195 0 CA-C-O 122.321 1.057 . . . . 0.0 113.094 174.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.596 ' CD ' ' H ' ' A' ' 44' ' ' ALA . 97.9 Cg_endo -115.04 -162.16 0.02 OUTLIER 'Trans proline' 0 N--CA 1.432 -2.146 1 C-N-CA 125.749 4.299 . . . . 0.0 107.686 143.3 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.775 HD12 HD12 ' A' ' 61' ' ' LEU . 52.5 mt -141.83 102.63 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.282 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 166.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -79.23 118.73 21.43 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 177.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.762 HG13 HG23 ' A' ' 50' ' ' ILE . 17.3 m -136.87 173.7 13.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-O 120.808 0.337 . . . . 0.0 111.313 -176.184 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -124.66 142.99 50.98 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 176.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 8.6 m -110.31 -39.25 5.02 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.683 -177.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 16.0 ptt180 179.46 -45.38 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.099 -0.5 . . . . 0.0 112.031 -177.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -132.27 -14.1 3.01 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -171.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.8 t -156.19 129.95 8.43 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.078 0.466 . . . . 0.0 110.279 -175.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.8 m -76.68 138.14 39.83 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.64 -177.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 16.6 mt -126.89 174.56 8.72 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.222 -175.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.442 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -134.78 161.24 35.73 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.35 178.392 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.775 HD12 HD12 ' A' ' 50' ' ' ILE . 4.2 pp -151.43 158.68 44.0 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 179.127 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.637 ' HD2' ' N ' ' A' ' 62' ' ' ARG . 6.3 mpt_? -109.32 176.35 5.12 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 -175.639 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -61.73 -38.27 87.28 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.032 178.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.44 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 55.0 tptt -64.53 -49.3 71.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.278 176.322 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -61.88 -39.33 91.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.587 179.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 55.6 tp -63.33 -37.82 88.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.817 178.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.66 -10.9 60.48 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.557 -178.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 64' ' ' LYS . 77.3 mt -87.07 -23.41 24.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.739 0.304 . . . . 0.0 111.05 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.579 HD12 HD13 ' A' ' 32' ' ' LEU . 95.7 mt -113.97 135.38 54.06 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.584 -178.64 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.9 m -90.4 115.85 27.89 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 174.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 80.2 mt -110.85 133.48 53.33 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.951 -175.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.3 m -114.55 114.87 44.71 Favored Pre-proline 0 C--N 1.319 -0.728 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.369 172.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.562 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 39.6 Cg_endo -68.31 163.0 38.05 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 121.988 1.792 . . . . 0.0 112.087 -177.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.488 HD11 ' HB3' ' A' ' 9' ' ' SER . 80.0 mt -76.28 1.76 15.17 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.412 175.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 32.5 t70 . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.408 -0.806 . . . . 0.0 109.808 178.131 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.2 mpt? . . . . . 0 N--CA 1.483 1.189 0 CA-C-O 120.455 0.169 . . . . 0.0 110.82 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.2 m 67.01 34.06 5.37 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.627 0.727 . . . . 0.0 109.542 -171.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -121.17 125.77 48.01 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.349 -0.842 . . . . 0.0 110.54 -178.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.646 ' HA ' ' HD2' ' A' ' 42' ' ' ARG . 1.2 pp -150.46 -178.84 6.77 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.359 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.461 ' O ' ' HA ' ' A' ' 42' ' ' ARG . 36.3 tt0 -151.1 84.5 5.3 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-O 120.857 0.36 . . . . 0.0 110.131 -178.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.4 ' HD3' HD12 ' A' ' 4' ' ' LEU . 92.2 Cg_endo -90.52 171.88 3.47 Favored 'Trans proline' 0 N--CA 1.452 -0.93 0 C-N-CA 122.951 2.434 . . . . 0.0 112.212 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 18.9 t -156.5 -85.39 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.58 177.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.405 ' O ' HG13 ' A' ' 40' ' ' VAL . 86.8 mtt-85 -143.99 -174.91 4.4 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 121.108 0.48 . . . . 0.0 111.178 -172.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.456 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 17.8 m -101.44 144.97 29.58 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.083 -178.194 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.757 ' HE2' ' HB ' ' A' ' 40' ' ' VAL . 39.1 m-85 -121.61 128.13 51.61 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 177.307 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.45 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 98.3 mtt180 -90.25 155.81 18.74 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.569 -0.452 . . . . 0.0 110.584 178.349 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.7 mt -105.77 111.47 35.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.829 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 3.0 p -81.14 -21.3 39.91 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.896 0.379 . . . . 0.0 110.822 179.311 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.533 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 159.51 -144.49 10.23 Favored Glycine 0 N--CA 1.439 -1.11 0 C-N-CA 120.109 -1.044 . . . . 0.0 112.134 177.331 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.451 ' CB ' HG23 ' A' ' 19' ' ' ILE . 21.3 m-85 -123.96 157.82 33.47 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -177.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.492 ' O ' HG22 ' A' ' 19' ' ' ILE . 20.4 m -59.49 134.98 88.86 Favored Pre-proline 0 N--CA 1.447 -0.592 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 172.202 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -48.05 -29.78 12.87 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 123.723 2.949 . . . . 0.0 114.736 -173.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -88.18 10.51 19.18 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -174.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.492 HG22 ' O ' ' A' ' 16' ' ' SER . 17.2 tt -77.71 114.74 18.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.492 0.663 . . . . 0.0 109.991 176.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.531 ' O ' ' HB2' ' A' ' 21' ' ' ASN . 65.4 m -165.83 99.17 0.66 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.825 -172.599 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.531 ' HB2' ' O ' ' A' ' 20' ' ' SER . 3.7 t30 171.37 33.27 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 177.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 73.47 -1.15 45.2 Favored Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.149 -173.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -60.55 -32.26 71.34 Favored 'General case' 0 C--N 1.334 -0.075 0 CA-C-O 120.774 0.321 . . . . 0.0 111.066 -175.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 11.8 mtp180 -62.27 -41.87 98.84 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.723 176.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -67.76 -34.69 77.31 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 120.963 0.411 . . . . 0.0 110.301 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.445 ' HA ' ' HD2' ' A' ' 26' ' ' ARG . 16.5 tpt180 -64.26 -42.91 96.25 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.771 -0.65 . . . . 0.0 109.978 176.028 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.643 HD13 HD21 ' A' ' 69' ' ' LEU . 90.6 mt -70.36 -38.08 74.71 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.504 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -59.53 -40.51 87.41 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.792 175.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 50.3 m -67.85 -33.23 74.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.838 179.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.899 ' HE2' ' HA ' ' A' ' 30' ' ' MET . 10.6 mmt -73.7 -23.17 59.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.868 178.39 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 109.28 12.67 19.29 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.894 -0.669 . . . . 0.0 112.343 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.4 mt -101.32 95.51 6.56 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.888 0.375 . . . . 0.0 110.325 -179.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -130.88 154.74 82.02 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.288 -177.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.533 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 27.9 Cg_exo -61.48 119.49 6.66 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.722 2.281 . . . . 0.0 111.713 178.041 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.75 -7.12 17.68 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.773 -0.727 . . . . 0.0 111.996 -177.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -94.33 -171.96 2.66 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 120.984 0.421 . . . . 0.0 110.192 178.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.45 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -155.22 148.13 24.51 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.714 -177.014 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.532 HD11 HG22 ' A' ' 52' ' ' VAL . 33.0 mt -125.52 132.63 52.58 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 178.595 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 42.9 ttp180 -98.27 124.23 42.78 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 178.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.757 ' HB ' ' HE2' ' A' ' 10' ' ' TYR . 8.1 p -69.1 126.09 28.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.344 0.592 . . . . 0.0 111.416 -174.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 65.2 t -97.44 -44.58 12.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.353 177.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.646 ' HD2' ' HA ' ' A' ' 4' ' ' LEU . 78.8 ttt180 -165.41 135.55 3.64 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.868 0.366 . . . . 0.0 111.551 176.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.7 mp -90.77 129.33 41.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 172.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.421 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -64.62 131.45 95.12 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-O 120.656 0.265 . . . . 0.0 110.385 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 44.5 Cg_exo -58.31 -18.6 38.77 Favored 'Trans proline' 0 CA--C 1.532 0.404 0 C-N-CA 123.236 2.624 . . . . 0.0 113.093 -177.258 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -88.42 -20.46 25.22 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.334 -177.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 101.29 -13.56 58.48 Favored Glycine 0 C--O 1.235 0.177 0 N-CA-C 111.212 -0.755 . . . . 0.0 111.212 -173.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.602 ' HB3' ' HD2' ' A' ' 49' ' ' PRO . 0.5 OUTLIER -62.72 169.21 3.48 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 114.986 -0.607 . . . . 0.0 110.522 172.706 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.602 ' HD2' ' HB3' ' A' ' 48' ' ' ASP . 12.0 Cg_exo -29.07 151.68 0.01 OUTLIER 'Trans proline' 0 C--N 1.361 1.217 1 C-N-CA 125.335 4.024 . . . . 0.0 116.059 -170.786 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.493 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 60.0 mt -110.83 133.72 55.41 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 113.87 -1.514 . . . . 0.0 109.734 -173.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 -84.83 118.87 24.74 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.304 -179.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.532 HG22 HD11 ' A' ' 38' ' ' LEU . 27.6 m -128.92 167.12 24.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.1 178.337 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -129.29 151.0 50.42 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 -177.748 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 18.4 p -119.46 -64.28 1.29 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.627 -179.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 55' ' ' ARG . 38.7 ttp180 -168.62 18.45 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.57 -176.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -148.29 -51.28 0.17 Allowed 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -172.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.4 t -173.02 167.2 5.01 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 -175.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.401 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 1.8 p -81.76 126.35 31.72 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.293 0.568 . . . . 0.0 111.417 -176.425 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 53.0 tp -118.87 147.22 44.2 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.79 -178.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.53 ' HB2' ' HB2' ' A' ' 49' ' ' PRO . . . -110.93 127.14 55.38 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.752 0.311 . . . . 0.0 110.602 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.409 ' O ' ' HA ' ' A' ' 49' ' ' PRO . 2.7 pp -103.59 132.78 49.55 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.456 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.701 ' HD3' ' OD2' ' A' ' 65' ' ' ASP . 0.5 OUTLIER -75.49 174.45 9.63 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.069 0.461 . . . . 0.0 111.136 -170.715 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 23.0 mmm180 -62.19 -33.55 74.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.177 174.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -62.14 -52.75 62.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.841 177.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.701 ' OD2' ' HD3' ' A' ' 62' ' ' ARG . 33.4 m-20 -63.01 -41.99 99.7 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.087 -179.198 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 54.1 tp -60.18 -38.49 83.39 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.799 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.31 -15.76 62.42 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.953 0.406 . . . . 0.0 111.404 -179.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 94.4 mt -108.25 -4.32 17.65 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.383 -179.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.643 HD21 HD13 ' A' ' 27' ' ' LEU . 82.7 mt -110.67 134.82 52.11 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.778 0.323 . . . . 0.0 110.95 -179.355 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 32.2 m -106.58 116.9 32.73 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.213 0.53 . . . . 0.0 110.287 174.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.8 mp -124.62 150.49 45.96 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.696 -177.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 16.9 m -130.33 123.21 20.42 Favored Pre-proline 0 C--N 1.319 -0.731 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 175.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.438 ' HB3' ' CD1' ' A' ' 10' ' ' TYR . 36.2 Cg_endo -66.48 164.15 29.74 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.031 1.821 . . . . 0.0 111.601 179.032 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 9' ' ' SER . 91.1 mt -54.59 -40.88 69.27 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.796 172.35 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 22.8 t70 . . . . . 0 C--O 1.248 0.984 0 O-C-N 124.065 0.853 . . . . 0.0 110.843 173.864 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.067 0 CA-C-O 120.906 0.384 . . . . 0.0 110.65 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.4 m -82.79 76.74 9.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.098 0.475 . . . . 0.0 111.603 -177.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.643 ' HB1' HH21 ' A' ' 42' ' ' ARG . . . -102.13 82.46 2.22 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.426 0.631 . . . . 0.0 109.365 174.228 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 64.0 tp -103.01 118.35 36.61 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.304 -173.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -144.57 94.06 5.64 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.781 173.058 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.41 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 15.3 Cg_exo -68.65 133.42 27.62 Favored 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 122.647 2.231 . . . . 0.0 111.521 178.552 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.403 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 22.7 t -93.32 -82.9 0.33 Allowed 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.915 -0.314 . . . . 0.0 110.159 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 53.2 mtt180 -129.52 -176.29 3.85 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 121.033 0.444 . . . . 0.0 110.733 -179.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.437 ' HB2' HD13 ' A' ' 74' ' ' LEU . 16.1 m -124.11 138.77 54.39 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.58 -178.565 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 52.3 m-85 -122.24 133.05 54.71 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.566 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 8.0 ptp180 -100.5 157.62 16.51 Favored 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 119.998 -0.681 . . . . 0.0 110.261 175.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.418 HG12 ' CD2' ' A' ' 71' ' ' LEU . 22.2 mt -100.64 116.35 43.94 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.944 -179.784 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 1.4 m -92.22 -19.75 21.89 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.882 -177.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 164.79 -149.41 16.12 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.424 -179.28 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.448 ' HB3' HG22 ' A' ' 19' ' ' ILE . 72.5 m-85 -121.97 152.63 39.5 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.828 0.347 . . . . 0.0 110.821 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.725 ' O ' HG21 ' A' ' 19' ' ' ILE . 49.4 m -82.24 153.25 68.85 Favored Pre-proline 0 N--CA 1.448 -0.542 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.887 -179.53 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -62.38 -16.26 50.48 Favored 'Trans proline' 0 CA--C 1.532 0.395 0 C-N-CA 122.693 2.262 . . . . 0.0 113.218 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -83.92 -7.18 59.49 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -177.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.725 HG21 ' O ' ' A' ' 16' ' ' SER . 10.4 tt -92.88 147.7 5.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 C-N-CA 120.556 -0.458 . . . . 0.0 110.719 -179.409 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.3 t -84.98 158.1 20.6 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.635 -0.505 . . . . 0.0 109.635 178.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.486 ' O ' ' HB3' ' A' ' 24' ' ' ARG . 26.8 t-20 -63.5 -47.48 81.54 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.649 0.261 . . . . 0.0 111.373 -174.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.73 -38.33 95.48 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.433 -0.889 . . . . 0.0 112.208 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -64.53 -39.89 94.6 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 177.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.486 ' HB3' ' O ' ' A' ' 21' ' ' ASN . 15.9 ttm180 -56.2 -45.22 79.92 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.376 172.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -68.91 -31.57 70.58 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.224 -178.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.46 ' O ' ' HG3' ' A' ' 30' ' ' MET . 4.0 tmm_? -68.71 -39.68 80.32 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 175.509 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.434 HD22 HD12 ' A' ' 32' ' ' LEU . 40.2 mt -68.18 -40.5 82.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.332 0.587 . . . . 0.0 110.317 176.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -55.57 -48.02 75.47 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.079 174.255 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 47.8 m -60.07 -33.89 72.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.15 178.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.46 ' HG3' ' O ' ' A' ' 26' ' ' ARG . 90.1 mtp -70.47 -27.33 64.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.898 178.649 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.77 8.07 11.22 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.356 -178.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.476 HD11 HD13 ' A' ' 69' ' ' LEU . 76.4 mt -99.69 94.03 6.14 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.009 0.433 . . . . 0.0 110.09 -179.388 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.522 ' HB2' ' HD2' ' A' ' 34' ' ' PRO . 1.7 pt? -140.31 161.83 53.03 Favored Pre-proline 0 N--CA 1.447 -0.596 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.496 -178.588 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.522 ' HD2' ' HB2' ' A' ' 33' ' ' LEU . 18.7 Cg_endo -59.74 128.46 27.01 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.867 2.378 . . . . 0.0 111.77 175.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 111.62 4.05 26.76 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.128 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -113.82 172.83 6.75 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 120.982 0.42 . . . . 0.0 110.132 178.201 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.566 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -152.89 139.66 18.95 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.412 -178.05 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.642 HD12 HG21 ' A' ' 52' ' ' VAL . 50.5 mt -127.16 136.72 52.47 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.193 -178.113 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 16.3 ttm180 -99.67 131.06 45.9 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 174.028 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.55 HG22 HD12 ' A' ' 43' ' ' ILE . 9.0 p -72.55 135.08 28.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.342 0.591 . . . . 0.0 111.695 -172.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 75.4 t -106.54 -47.34 8.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.643 176.331 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.643 HH21 ' HB1' ' A' ' 3' ' ' ALA . 79.0 mtt180 -157.64 138.91 13.57 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -172.533 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.55 HD12 HG22 ' A' ' 40' ' ' VAL . 4.5 mp -130.0 119.87 48.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 163.39 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.637 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -67.62 138.19 93.41 Favored Pre-proline 0 C--N 1.322 -0.607 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.125 -176.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -58.88 -19.17 45.99 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 123.618 2.879 . . . . 0.0 112.924 -178.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -55.96 -39.62 72.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.723 0.773 . . . . 0.0 110.727 176.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 162.16 -74.52 0.19 Allowed Glycine 0 CA--C 1.494 -1.23 0 N-CA-C 110.509 -1.036 . . . . 0.0 110.509 -175.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.635 ' OD1' HG13 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -163.23 120.72 1.23 Allowed Pre-proline 0 N--CA 1.436 -1.132 0 N-CA-C 115.543 1.683 . . . . 0.0 115.543 176.897 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.637 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 31.3 Cg_endo -116.33 155.08 0.03 OUTLIER 'Trans proline' 0 N--CA 1.437 -1.798 1 C-N-CA 125.348 4.032 . . . . 0.0 108.439 123.614 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.899 HD13 HD21 ' A' ' 66' ' ' LEU . 96.0 mt -118.45 103.81 15.18 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.721 0 C-N-CA 119.209 -0.997 . . . . 0.0 110.938 -177.535 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.688 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 36.0 mt-30 -92.9 123.31 36.07 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.979 177.199 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.642 HG21 HD12 ' A' ' 38' ' ' LEU . 27.1 m -139.68 170.3 15.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.164 -177.653 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -116.9 135.48 53.69 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.1 m -110.29 -41.24 4.45 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.673 -172.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.7 ttm180 -176.72 -37.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.747 -173.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -120.93 -53.44 2.06 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.879 0.371 . . . . 0.0 110.638 -174.464 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.6 t -142.31 175.07 10.05 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 -174.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.484 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 13.9 m -88.53 134.05 33.98 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-O 121.318 0.58 . . . . 0.0 110.624 -178.725 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.688 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 3.1 mm? -112.02 173.72 6.22 Favored 'General case' 0 C--N 1.317 -0.848 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.178 179.486 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.587 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -142.19 144.4 33.39 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.088 -178.416 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -154.36 -175.34 5.35 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 -178.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.425 ' HA ' ' HD3' ' A' ' 62' ' ' ARG . 19.6 mmt180 -107.42 160.27 15.76 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 122.208 1.004 . . . . 0.0 112.792 -178.445 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -56.0 -41.44 74.87 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 113.008 -1.905 . . . . 0.0 112.094 -179.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.537 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 42.8 tttp -66.97 -43.11 83.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.714 0.292 . . . . 0.0 110.489 -176.152 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -59.71 -40.68 88.75 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.145 177.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.899 HD21 HD13 ' A' ' 50' ' ' ILE . 10.4 tp -70.48 -39.02 74.48 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.632 179.566 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.74 -26.84 66.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.456 -179.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.617 ' HB3' ' HB ' ' A' ' 19' ' ' ILE . 94.6 mt -77.51 -7.65 56.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.983 0.421 . . . . 0.0 110.564 177.564 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.476 HD13 HD11 ' A' ' 32' ' ' LEU . 68.5 mt -99.02 140.91 32.47 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.662 174.342 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 28.7 m -85.74 114.05 22.4 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 172.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.554 HD12 ' HG ' ' A' ' 66' ' ' LEU . 68.9 mt -120.3 139.12 53.2 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.626 -174.332 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.425 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 28.5 m -127.0 129.52 23.97 Favored Pre-proline 0 C--N 1.318 -0.799 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.496 170.054 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 72' ' ' VAL . 3.3 Cg_exo -75.65 162.43 35.46 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 122.108 1.872 . . . . 0.0 111.736 -179.289 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.437 HD13 ' HB2' ' A' ' 9' ' ' SER . 60.7 mt -69.78 -34.62 74.01 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.204 172.55 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 37.1 t70 . . . . . 0 C--O 1.25 1.121 0 CA-C-O 118.611 -0.709 . . . . 0.0 109.834 177.906 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.1 mtt . . . . . 0 N--CA 1.482 1.134 0 CA-C-O 120.611 0.243 . . . . 0.0 110.535 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.1 m -76.15 91.24 3.14 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.042 0.449 . . . . 0.0 111.633 -177.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -112.78 39.09 2.6 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.638 0.732 . . . . 0.0 109.173 173.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.515 HD21 HG11 ' A' ' 41' ' ' VAL . 61.1 mt -102.29 141.33 35.29 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.113 -173.356 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -155.19 93.96 2.66 Favored Pre-proline 0 C--N 1.325 -0.479 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.116 175.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.6 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 25.4 Cg_exo -63.36 139.3 70.57 Favored 'Trans proline' 0 N--CA 1.464 -0.231 0 C-N-CA 123.056 2.504 . . . . 0.0 112.43 -179.531 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 48.0 t -126.9 -80.07 0.6 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.104 -179.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 42.2 mtp85 -115.45 152.85 32.17 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.12 0.486 . . . . 0.0 111.475 -175.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.434 ' HB2' HD12 ' A' ' 74' ' ' LEU . 7.8 m -117.12 143.87 45.32 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.062 177.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 93.9 m-85 -128.89 140.03 51.87 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.813 0.339 . . . . 0.0 110.863 -175.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.53 ' HD3' ' HB3' ' A' ' 37' ' ' ALA . 28.7 mmt180 -83.75 150.91 25.51 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.829 175.21 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.583 HG12 ' CD2' ' A' ' 71' ' ' LEU . 46.0 mt -103.06 113.07 38.76 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 169.425 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 6.7 p -90.32 -11.68 40.01 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.06 0.457 . . . . 0.0 111.092 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 161.2 -158.33 30.0 Favored Glycine 0 N--CA 1.442 -0.955 0 C-N-CA 120.293 -0.956 . . . . 0.0 112.175 177.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 48.2 m-85 -114.99 150.17 36.23 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 -179.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 53.0 m -72.22 137.89 81.56 Favored Pre-proline 0 C--N 1.316 -0.884 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.424 -179.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -52.88 156.3 9.63 Favored 'Trans proline' 0 C--O 1.237 0.474 0 C-N-CA 122.941 2.427 . . . . 0.0 112.548 178.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 75.01 12.9 3.39 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.289 -177.143 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 16.0 tt -83.94 146.71 6.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.192 176.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.9 t -74.44 140.31 44.56 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 178.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -62.06 -49.83 74.4 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.917 -177.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.45 -31.27 80.32 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.976 -0.631 . . . . 0.0 112.359 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.433 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 21.5 t80 -72.59 -37.46 68.14 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.433 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.8 ttm180 -59.14 -43.0 91.99 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.759 172.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -66.04 -39.18 89.94 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.386 177.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 26' ' ' ARG . 5.1 tpt180 -63.44 -39.31 94.14 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.019 178.268 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 23' ' ' TYR . 95.5 mt -66.58 -45.01 80.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.805 177.411 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -55.89 -47.77 76.82 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.3 176.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 50.3 m -60.93 -35.31 76.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.135 179.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 71.9 mtm -78.96 -14.98 58.89 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.75 -178.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 114.28 6.21 20.41 Favored Glycine 0 N--CA 1.453 -0.209 0 C-N-CA 120.331 -0.938 . . . . 0.0 113.026 175.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.648 HD13 HD11 ' A' ' 69' ' ' LEU . 82.6 mt -99.87 87.04 3.41 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 178.634 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.42 ' HB2' ' HD2' ' A' ' 34' ' ' PRO . 1.8 pt? -129.99 157.64 76.33 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.757 -177.186 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.42 ' HD2' ' HB2' ' A' ' 33' ' ' LEU . 18.0 Cg_endo -61.06 123.75 13.51 Favored 'Trans proline' 0 C--O 1.235 0.341 0 C-N-CA 122.534 2.156 . . . . 0.0 111.577 177.05 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 111.9 -17.43 24.98 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 121.04 -0.6 . . . . 0.0 111.856 -176.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -91.84 111.44 22.97 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.068 0.461 . . . . 0.0 110.234 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.53 ' HB3' ' HD3' ' A' ' 11' ' ' ARG . . . -90.37 129.06 36.62 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.828 177.353 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.41 ' N ' HD21 ' A' ' 38' ' ' LEU . 2.8 mm? -104.31 143.54 32.84 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.561 178.367 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' ' 39' ' ' ARG . 36.1 ttm180 -105.21 124.62 49.85 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.339 176.482 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.6 ' O ' ' HA ' ' A' ' 6' ' ' PRO . 5.8 p -66.87 125.88 25.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.18 0.515 . . . . 0.0 110.377 -178.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.515 HG11 HD21 ' A' ' 4' ' ' LEU . 21.2 t -104.97 -39.46 5.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.543 -178.475 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 19.6 ttm180 -158.1 121.71 4.01 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 121.095 -0.242 . . . . 0.0 110.887 179.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.445 ' HA ' HG21 ' A' ' 50' ' ' ILE . 4.2 mp -97.42 130.37 46.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 178.514 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.448 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -75.58 134.69 72.5 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 174.824 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 24.7 Cg_exo -64.16 -4.34 7.58 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 123.113 2.542 . . . . 0.0 113.425 -174.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 7.0 mp -93.36 -20.83 19.97 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.663 0.268 . . . . 0.0 111.113 -179.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.62 -16.93 60.25 Favored Glycine 0 N--CA 1.453 -0.231 0 N-CA-C 110.774 -0.93 . . . . 0.0 110.774 -172.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.772 ' HB3' ' HD2' ' A' ' 49' ' ' PRO . 0.4 OUTLIER -69.43 170.05 10.39 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 114.72 -0.74 . . . . 0.0 109.594 171.726 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.8 ' HD3' ' HD3' ' A' ' 62' ' ' ARG . 5.6 Cg_exo -32.37 150.0 0.02 OUTLIER 'Trans proline' 0 C--N 1.361 1.209 0 C-N-CA 124.849 3.699 . . . . 0.0 116.718 -155.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.445 HG21 ' HA ' ' A' ' 43' ' ' ILE . 69.1 mt -124.07 134.22 67.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-N 113.684 -1.598 . . . . 0.0 109.634 -173.642 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.438 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 2.3 mp0 -78.76 120.69 23.76 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 177.686 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.442 ' O ' ' HA ' ' A' ' 58' ' ' SER . 27.3 m -128.4 160.01 39.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.666 -178.009 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -112.37 130.82 55.83 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.715 -173.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.5 t -104.09 -34.44 8.41 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.979 176.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 34.1 mtp180 -153.34 -89.35 0.05 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.526 177.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -112.89 0.79 15.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.484 -178.084 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.5 t -133.0 154.7 50.27 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.878 -177.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.442 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 7.2 m -104.92 139.21 39.97 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.663 -178.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.438 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 7.4 mp -118.0 173.23 6.89 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.942 178.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -142.52 141.78 32.13 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.667 0.27 . . . . 0.0 110.766 -179.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.565 ' O ' ' HA ' ' A' ' 49' ' ' PRO . 3.3 pp -143.97 150.99 39.16 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 178.638 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.8 ' HD3' ' HD3' ' A' ' 49' ' ' PRO . 32.1 mmt180 -73.77 174.16 8.82 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 121.382 0.611 . . . . 0.0 111.173 -176.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 16.9 ptt180 -70.35 -33.7 71.77 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.895 179.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.439 ' HD2' ' C ' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -57.41 -47.4 81.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.074 174.14 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -68.28 -37.7 80.93 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.955 -177.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 38.8 tp -59.31 -38.94 81.54 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.842 177.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.93 -25.63 63.75 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.153 -178.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 82.0 mt -83.91 -8.6 59.14 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.23 -177.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.648 HD11 HD13 ' A' ' 32' ' ' LEU . 96.9 mt -103.86 132.7 49.86 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 110.251 -0.277 . . . . 0.0 110.251 178.036 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.0 m -89.43 114.18 25.62 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 175.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.583 ' CD2' HG12 ' A' ' 12' ' ' ILE . 73.6 mt -118.71 132.21 56.15 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.001 -173.391 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 27.2 m -122.06 132.77 24.19 Favored Pre-proline 0 C--N 1.318 -0.804 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.625 173.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -69.45 163.41 38.11 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 121.84 1.693 . . . . 0.0 112.426 -176.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.434 HD12 ' HB2' ' A' ' 9' ' ' SER . 85.9 mt -67.04 -14.97 63.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.732 173.116 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.6 t0 . . . . . 0 C--O 1.252 1.204 0 O-C-N 124.165 0.916 . . . . 0.0 110.318 -178.231 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.482 1.128 0 CA-C-O 121.024 0.44 . . . . 0.0 109.827 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.5 t -104.07 110.37 22.52 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 177.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -95.95 99.18 10.99 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.297 -178.009 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.565 ' HG ' HG13 ' A' ' 41' ' ' VAL . 6.4 mp -97.48 122.41 40.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.189 -0.459 . . . . 0.0 109.811 175.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -122.29 85.02 47.0 Favored Pre-proline 0 C--N 1.32 -0.674 0 N-CA-C 109.408 -0.589 . . . . 0.0 109.408 177.294 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.477 ' HA ' HG11 ' A' ' 40' ' ' VAL . 40.5 Cg_endo -69.27 105.36 1.39 Allowed 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 122.274 1.983 . . . . 0.0 112.861 -176.367 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.9 t -82.99 -54.67 4.89 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.172 176.156 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 -155.79 144.77 20.58 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 176.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.483 ' HB2' HD12 ' A' ' 74' ' ' LEU . 15.1 m -90.94 140.7 29.58 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 -179.598 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -124.27 142.22 51.43 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.843 0.354 . . . . 0.0 110.7 -175.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.558 ' HG3' HD21 ' A' ' 74' ' ' LEU . 90.6 mtt-85 -99.05 157.25 16.47 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.717 175.422 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 49.7 mt -94.07 112.99 27.85 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.739 179.006 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.96 -33.35 70.38 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.434 0.635 . . . . 0.0 110.156 178.154 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.549 ' HA2' ' HB3' ' A' ' 34' ' ' PRO . . . 153.94 -147.36 16.59 Favored Glycine 0 N--CA 1.444 -0.807 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.329 -179.655 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -113.61 160.56 18.43 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 -179.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.43 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 34.0 t -62.8 133.01 94.96 Favored Pre-proline 0 C--N 1.321 -0.665 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 172.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 31.7 Cg_exo -60.1 -16.53 40.2 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.895 2.396 . . . . 0.0 112.727 -178.683 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -103.6 24.33 11.3 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.081 -178.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 18.4 tt -71.2 155.01 7.67 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 175.564 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.1 p -124.24 127.15 47.26 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -172.113 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.486 ' HB3' ' H ' ' A' ' 22' ' ' GLY . 16.7 m120 64.94 -156.32 0.29 Allowed 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.222 -0.899 . . . . 0.0 112.478 168.615 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.486 ' H ' ' HB3' ' A' ' 21' ' ' ASN . . . -75.14 15.09 4.39 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 115.337 -0.847 . . . . 0.0 113.356 -175.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 29.1 t80 -61.95 -36.09 80.38 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 174.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 4.4 tmm_? -64.62 -39.77 94.29 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.373 175.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -68.58 -35.31 77.2 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.246 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.402 ' O ' ' HG3' ' A' ' 30' ' ' MET . 62.8 ttt180 -64.4 -41.44 96.64 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.691 176.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.801 HD11 HD23 ' A' ' 69' ' ' LEU . 83.7 mt -67.17 -43.66 81.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.186 177.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -59.5 -44.58 93.05 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.502 178.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.3 m -64.24 -33.77 76.58 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.886 179.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.402 ' HG3' ' O ' ' A' ' 26' ' ' ARG . 70.4 mtm -78.12 -16.47 57.93 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.327 -178.163 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 112.78 11.87 13.7 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.427 -0.892 . . . . 0.0 113.013 174.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 94.4 mt -100.63 95.9 7.0 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.794 0.331 . . . . 0.0 110.321 179.447 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -132.52 152.81 80.66 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.686 -179.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.549 ' HB3' ' HA2' ' A' ' 14' ' ' GLY . 24.0 Cg_endo -62.4 139.14 75.22 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.855 2.37 . . . . 0.0 112.132 179.11 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 107.36 -26.33 18.84 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.298 178.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.07 -172.47 4.15 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 121.141 0.496 . . . . 0.0 110.212 -178.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.549 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -145.28 144.06 30.55 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.066 -176.606 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.414 HD13 HG22 ' A' ' 52' ' ' VAL . 84.1 mt -118.47 137.82 52.92 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.687 178.013 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 40.2 ttt85 -101.71 117.62 35.25 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.522 ' HA ' HG11 ' A' ' 52' ' ' VAL . 14.5 p -62.48 127.1 21.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.66 0.743 . . . . 0.0 111.707 -176.253 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.565 HG13 ' HG ' ' A' ' 4' ' ' LEU . 91.6 t -90.4 -61.26 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.969 170.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 50.1 mtp180 -167.13 155.43 9.69 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 123.72 0.638 . . . . 0.0 111.597 -177.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.461 HG23 ' HD2' ' A' ' 49' ' ' PRO . 3.3 mp -117.15 116.7 52.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 163.565 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -54.13 135.02 59.29 Favored Pre-proline 0 C--N 1.326 -0.416 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -67.86 -1.58 7.12 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.812 2.341 . . . . 0.0 112.141 179.133 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.409 HD11 ' HA ' ' A' ' 46' ' ' LEU . 3.9 mm? -63.8 -28.8 70.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.577 174.268 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 157.46 -76.59 0.2 Allowed Glycine 0 N--CA 1.438 -1.181 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.939 -176.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -167.78 120.01 0.72 Allowed Pre-proline 0 N--CA 1.448 -0.543 0 N-CA-C 113.882 1.067 . . . . 0.0 113.882 176.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.461 ' HD2' HG23 ' A' ' 43' ' ' ILE . 81.1 Cg_endo -118.67 -168.72 0.02 OUTLIER 'Trans proline' 0 N--CA 1.433 -2.055 1 C-N-CA 126.372 4.715 . . . . 0.0 108.243 140.318 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.73 HD11 HD13 ' A' ' 61' ' ' LEU . 62.6 mt -140.67 100.62 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 168.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.411 ' OE1' ' HB1' ' A' ' 60' ' ' ALA . 5.3 tp60 -86.93 116.52 25.04 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 178.478 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.522 HG11 ' HA ' ' A' ' 40' ' ' VAL . 11.5 m -136.79 175.97 8.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.528 0.204 . . . . 0.0 110.56 -177.851 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.409 ' HG2' ' N ' ' A' ' 55' ' ' ARG . 40.8 tt0 -147.17 138.88 24.19 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 176.065 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -86.16 27.23 0.93 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.093 0.473 . . . . 0.0 109.912 176.745 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.409 ' N ' ' HG2' ' A' ' 53' ' ' GLU . 43.3 ttm105 67.1 16.01 10.19 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 121.904 0.859 . . . . 0.0 109.923 -175.833 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -139.42 -70.55 0.4 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.382 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 17.0 m -114.61 141.65 47.5 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.046 177.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 23.1 p -85.32 146.98 26.76 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.954 0.407 . . . . 0.0 110.491 176.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 15.9 mt -141.19 167.35 22.38 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.639 -179.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.491 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -137.93 154.77 49.38 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 114.678 -1.146 . . . . 0.0 109.873 -179.385 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.73 HD13 HD11 ' A' ' 50' ' ' ILE . 1.3 pp -157.31 168.3 27.78 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 -179.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.64 ' HD3' ' OD2' ' A' ' 65' ' ' ASP . 0.1 OUTLIER -107.63 172.49 6.8 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.042 0.449 . . . . 0.0 110.329 -176.899 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.506 ' HG3' ' N ' ' A' ' 64' ' ' LYS . 0.2 OUTLIER -59.97 -34.03 72.74 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.549 174.258 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.506 ' N ' ' HG3' ' A' ' 63' ' ' ARG . 1.5 tmtp? -62.5 -40.91 98.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.969 -1.014 . . . . 0.0 110.297 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.64 ' OD2' ' HD3' ' A' ' 62' ' ' ARG . 26.1 m-20 -72.94 -37.86 66.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.797 179.168 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 53.0 tp -61.27 -31.63 71.45 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.481 177.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.11 -10.9 60.41 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.302 178.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 95.9 mt -110.59 -5.29 15.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.962 0.411 . . . . 0.0 110.815 179.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.801 HD23 HD11 ' A' ' 27' ' ' LEU . 98.7 mt -123.53 125.29 44.62 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.623 -177.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 6.7 m -91.53 114.25 26.73 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.009 0.433 . . . . 0.0 110.065 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 8.9 mp -125.65 143.61 50.96 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.466 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 15.6 m -137.23 159.15 70.82 Favored Pre-proline 0 C--N 1.32 -0.697 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.643 178.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -61.29 167.64 9.09 Favored 'Trans proline' 0 C--O 1.234 0.284 0 C-N-CA 122.206 1.938 . . . . 0.0 112.068 177.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.558 HD21 ' HG3' ' A' ' 11' ' ' ARG . 86.3 mt -54.42 -56.25 20.57 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.985 0.421 . . . . 0.0 110.383 176.441 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.6 t0 . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.259 -0.876 . . . . 0.0 109.287 177.858 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.5 mpp? . . . . . 0 N--CA 1.481 1.113 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.7 m 61.28 86.7 0.1 Allowed 'General case' 0 C--N 1.33 -0.272 0 O-C-N 123.759 0.662 . . . . 0.0 111.755 178.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -72.13 93.58 1.44 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.905 177.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 80.9 mt -109.71 106.87 16.69 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.055 -174.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 21.7 pt20 -122.61 88.09 49.63 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 116.022 -0.536 . . . . 0.0 109.923 176.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -71.01 150.26 60.31 Favored 'Trans proline' 0 N--CA 1.463 -0.288 0 C-N-CA 122.949 2.433 . . . . 0.0 112.154 -179.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 38.5 t -92.31 -74.11 0.53 Allowed 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 177.003 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 87.9 mtt180 -133.68 179.67 6.09 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 121.384 0.612 . . . . 0.0 110.884 -179.08 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 37.3 m -124.59 129.64 50.95 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.085 176.211 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -113.99 149.18 35.72 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.917 0.389 . . . . 0.0 110.87 -174.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 78.7 mtp180 -105.46 153.24 21.98 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 174.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.648 HD11 ' HB3' ' A' ' 36' ' ' ALA . 35.2 mt -97.2 105.58 17.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 177.354 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.417 ' HG1' HG12 ' A' ' 72' ' ' VAL . 0.2 OUTLIER -67.66 -31.45 71.46 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.4 0.619 . . . . 0.0 110.188 179.059 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 160.09 -153.49 24.46 Favored Glycine 0 N--CA 1.443 -0.89 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.311 -178.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 66.2 m-85 -99.38 162.39 13.07 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 179.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.7 t -69.63 132.67 89.05 Favored Pre-proline 0 C--N 1.317 -0.845 0 N-CA-C 109.103 -0.702 . . . . 0.0 109.103 172.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -63.33 -7.07 11.29 Favored 'Trans proline' 0 C--O 1.233 0.255 0 C-N-CA 122.595 2.197 . . . . 0.0 112.67 -178.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.37 1.71 56.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.287 178.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 14.7 tt -75.12 146.75 9.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 179.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.7 t -160.37 -178.95 7.28 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 121.166 -0.214 . . . . 0.0 110.451 -177.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.4 t30 70.78 7.4 6.2 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 123.731 0.812 . . . . 0.0 111.767 175.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.7 14.13 61.79 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.542 -0.837 . . . . 0.0 113.051 177.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -65.28 -24.16 67.23 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.002 0.429 . . . . 0.0 110.085 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 24' ' ' ARG . 25.8 ttt180 -53.1 -48.66 67.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.578 173.566 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -64.98 -28.17 69.33 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.353 -179.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 26.5 tpt180 -74.33 -40.96 61.84 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.852 176.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.689 HD23 HD13 ' A' ' 32' ' ' LEU . 46.1 mt -66.91 -42.1 86.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.755 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -59.72 -43.15 94.29 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.923 177.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 70.1 m -63.15 -30.69 71.79 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.323 177.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 89.3 mtp -80.23 -16.18 55.34 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.218 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 108.98 10.82 23.76 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.479 -0.867 . . . . 0.0 112.647 176.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.883 HD12 HD12 ' A' ' 69' ' ' LEU . 84.8 mt -101.42 100.11 10.54 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.961 0.41 . . . . 0.0 109.925 179.374 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -131.8 156.12 80.52 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.817 -177.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -64.69 125.44 14.88 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.719 2.28 . . . . 0.0 111.473 176.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 109.55 -1.07 30.73 Favored Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.652 -0.785 . . . . 0.0 112.838 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.648 ' HB3' HD11 ' A' ' 12' ' ' ILE . . . -88.4 -172.75 3.9 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 120.989 0.423 . . . . 0.0 110.046 178.807 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -158.13 146.88 19.09 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.455 -177.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.413 HD12 HG21 ' A' ' 52' ' ' VAL . 82.5 mt -137.74 139.85 40.35 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.925 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 52.5 ttm-85 -101.72 124.85 48.05 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 175.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.559 ' HA ' HG13 ' A' ' 52' ' ' VAL . 9.3 p -75.88 122.69 30.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.522 0.677 . . . . 0.0 110.622 -177.239 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.584 HG13 ' HG3' ' A' ' 42' ' ' ARG . 48.9 t -93.73 -52.9 9.13 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.36 178.279 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.584 ' HG3' HG13 ' A' ' 41' ' ' VAL . 96.5 mtt180 -152.74 140.39 19.86 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -174.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.459 HD11 HG21 ' A' ' 40' ' ' VAL . 4.5 mp -116.27 144.22 24.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 164.783 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.539 ' H ' ' CD ' ' A' ' 49' ' ' PRO . . . -81.94 138.36 46.42 Favored Pre-proline 0 C--N 1.318 -0.785 0 CA-C-N 117.788 0.267 . . . . 0.0 110.923 178.645 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -66.14 -5.31 12.07 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 123.24 2.626 . . . . 0.0 112.56 179.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -65.53 -35.89 82.2 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.206 174.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 158.65 -77.49 0.19 Allowed Glycine 0 N--CA 1.438 -1.226 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.037 -176.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -153.62 120.03 2.88 Favored Pre-proline 0 N--CA 1.445 -0.724 0 N-CA-C 114.501 1.297 . . . . 0.0 114.501 179.302 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.539 ' CD ' ' H ' ' A' ' 44' ' ' ALA . 94.6 Cg_endo -119.51 -173.51 0.02 OUTLIER 'Trans proline' 0 N--CA 1.436 -1.854 1 C-N-CA 126.482 4.788 . . . . 0.0 107.693 131.301 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.687 HG22 HG12 ' A' ' 52' ' ' VAL . 57.1 mt -142.1 100.85 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.425 0 C-N-CA 119.749 -0.78 . . . . 0.0 109.942 170.81 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.55 HE22 ' HB3' ' A' ' 58' ' ' SER . 0.0 OUTLIER -87.57 112.57 22.41 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 178.437 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.687 HG12 HG22 ' A' ' 50' ' ' ILE . 24.2 m -129.41 -177.12 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.831 0.348 . . . . 0.0 110.59 -177.058 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -133.74 132.1 40.18 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 174.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.4 m -76.79 -30.98 56.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.082 0.467 . . . . 0.0 110.931 -176.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.3 ptp180 173.72 -26.26 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.642 -178.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -155.25 -36.73 0.09 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.166 -179.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.7 t -96.88 141.73 29.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.416 -179.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.55 ' HB3' HE22 ' A' ' 51' ' ' GLN . 45.4 m -80.95 146.59 30.67 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.618 178.445 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.8 tp -138.62 159.92 40.9 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.296 -179.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.561 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -138.94 156.84 46.93 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.927 -0.398 . . . . 0.0 109.927 177.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.666 HD12 HD11 ' A' ' 50' ' ' ILE . 3.7 pp -161.94 168.8 22.28 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -178.119 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.638 ' HD3' ' OD2' ' A' ' 65' ' ' ASP . 0.0 OUTLIER -109.43 169.04 8.95 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.448 0.642 . . . . 0.0 111.293 -177.603 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.563 ' HD2' ' N ' ' A' ' 64' ' ' LYS . 2.0 ppt_? -58.35 -33.25 69.35 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.69 -1.141 . . . . 0.0 111.796 176.223 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.563 ' N ' ' HD2' ' A' ' 63' ' ' ARG . 88.6 tttt -63.96 -44.61 92.27 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.489 176.406 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.638 ' OD2' ' HD3' ' A' ' 62' ' ' ARG . 23.3 m-20 -65.94 -36.8 84.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.287 0.565 . . . . 0.0 109.596 177.757 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.3 tp -59.25 -35.68 74.12 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.621 175.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.87 -10.48 58.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.622 -178.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 78.5 mt -94.84 -13.85 25.15 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.958 0.409 . . . . 0.0 110.444 178.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.883 HD12 HD12 ' A' ' 32' ' ' LEU . 96.7 mt -115.03 150.08 36.44 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.071 0.462 . . . . 0.0 110.865 -177.615 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 22.6 m -108.51 118.89 37.95 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.368 -0.605 . . . . 0.0 109.368 170.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 77.9 mt -120.02 138.41 53.53 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.99 -174.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.427 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 19.7 m -130.73 134.42 25.99 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.659 174.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 72' ' ' VAL . 27.7 Cg_exo -62.07 164.59 16.55 Favored 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 122.283 1.989 . . . . 0.0 112.103 179.499 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 96.0 mt -53.25 -42.1 66.13 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.538 175.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 33.9 t70 . . . . . 0 C--O 1.247 0.962 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.77 177.607 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.0 ttm . . . . . 0 N--CA 1.479 1.006 0 CA-C-O 120.624 0.25 . . . . 0.0 110.907 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.0 m -78.3 108.59 11.74 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -174.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 70.34 151.87 0.1 Allowed 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.071 -0.968 . . . . 0.0 112.592 174.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 92.9 mt -136.32 152.27 50.49 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.122 175.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.4 pm0 -88.22 149.79 45.74 Favored Pre-proline 0 C--N 1.322 -0.589 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.649 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 18.0 Cg_endo -61.28 104.4 0.29 Allowed 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 121.914 1.742 . . . . 0.0 110.687 175.608 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 29.7 t -93.52 -76.73 0.47 Allowed 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.176 -171.053 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.402 ' HD2' ' HA ' ' A' ' 8' ' ' ARG . 0.5 OUTLIER -93.66 164.88 12.98 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.99 0.424 . . . . 0.0 110.487 -177.057 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.445 ' OG ' ' HG3' ' A' ' 39' ' ' ARG . 16.6 m -132.51 139.18 47.81 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.886 178.386 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -120.4 133.44 55.43 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.116 -177.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.647 HH11 ' HB3' ' A' ' 37' ' ' ALA . 21.8 mmm180 -89.21 148.52 23.57 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 178.33 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.526 HG12 ' CD2' ' A' ' 71' ' ' LEU . 47.7 mt -102.42 113.06 37.87 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 175.364 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 4.5 p -81.21 -23.37 38.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.859 0.361 . . . . 0.0 110.904 179.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 161.75 -145.89 11.43 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 120.457 -0.878 . . . . 0.0 112.102 -178.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -117.99 154.55 31.78 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.161 0.505 . . . . 0.0 110.889 -175.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.437 ' O ' HG21 ' A' ' 19' ' ' ILE . 43.3 t -73.64 139.99 78.05 Favored Pre-proline 0 C--N 1.318 -0.782 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.319 174.148 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 31.3 Cg_exo -60.5 -8.73 9.43 Favored 'Trans proline' 0 N--CA 1.475 0.398 0 C-N-CA 123.152 2.568 . . . . 0.0 113.341 -178.814 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.63 -6.36 58.93 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.515 179.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.437 HG21 ' O ' ' A' ' 16' ' ' SER . 16.5 tt -79.23 139.47 18.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-O 120.909 0.385 . . . . 0.0 110.006 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.8 p -153.41 170.97 19.4 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -176.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 67.62 38.01 3.17 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.578 172.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.94 21.04 75.12 Favored Glycine 0 N--CA 1.454 -0.136 0 C-N-CA 121.027 -0.606 . . . . 0.0 113.594 174.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.404 ' HB3' ' CG1' ' A' ' 19' ' ' ILE . 7.3 t80 -66.83 -22.83 65.99 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.829 0.347 . . . . 0.0 110.446 -177.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 32.1 mtp180 -64.52 -40.89 96.45 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.663 175.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -69.12 -35.52 76.5 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 120.989 0.423 . . . . 0.0 110.141 179.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -66.06 -42.18 89.78 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.872 177.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.532 HD21 HD11 ' A' ' 32' ' ' LEU . 61.2 mt -70.97 -34.95 71.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.537 -179.785 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -58.46 -44.32 89.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.35 176.405 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 49.3 m -61.44 -35.34 77.31 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.806 178.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 91.9 mtp -75.79 -36.34 59.78 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.51 -178.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.04 14.97 5.34 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.202 -178.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.532 HD11 HD21 ' A' ' 27' ' ' LEU . 94.5 mt -104.46 91.98 4.12 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.911 0.386 . . . . 0.0 110.25 179.375 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.495 ' HB2' ' HD2' ' A' ' 34' ' ' PRO . 1.7 pt? -137.83 160.54 64.35 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.392 -179.224 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.495 ' HD2' ' HB2' ' A' ' 33' ' ' LEU . 13.8 Cg_endo -57.44 129.99 36.78 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.797 2.331 . . . . 0.0 111.659 176.716 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 110.75 -17.27 27.93 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.227 -177.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.66 100.55 12.9 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.913 0.387 . . . . 0.0 110.714 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.647 ' HB3' HH11 ' A' ' 11' ' ' ARG . . . -75.8 134.55 40.37 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.906 177.421 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 34.7 mt -110.21 135.91 50.25 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.567 -178.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.538 ' HB2' ' HB3' ' A' ' 53' ' ' GLU . 0.3 OUTLIER -94.55 147.44 23.27 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 172.928 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.649 ' O ' ' HA ' ' A' ' 6' ' ' PRO . 11.8 p -85.15 124.11 39.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-O 120.831 0.348 . . . . 0.0 111.036 -176.318 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 96.0 t -102.63 -50.19 9.93 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 C-N-CA 120.776 -0.37 . . . . 0.0 110.678 173.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.1 ttm180 -177.12 158.04 1.46 Allowed 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -175.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 46.7 mm -129.85 141.7 45.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 170.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.542 ' HB1' ' CD ' ' A' ' 49' ' ' PRO . . . -65.63 152.54 92.51 Favored Pre-proline 0 N--CA 1.469 0.522 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -179.49 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -69.07 -32.1 22.17 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 122.728 2.285 . . . . 0.0 112.616 175.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.416 HD13 ' HA ' ' A' ' 46' ' ' LEU . 4.0 mm? -65.51 -88.58 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.809 0.814 . . . . 0.0 110.45 177.095 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.538 ' O ' ' HB3' ' A' ' 48' ' ' ASP . . . -115.08 -79.27 0.82 Allowed Glycine 0 N--CA 1.432 -1.602 0 N-CA-C 109.119 -1.592 . . . . 0.0 109.119 169.305 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.558 ' OD1' ' HD3' ' A' ' 63' ' ' ARG . 6.0 p-10 166.98 133.3 0.04 OUTLIER Pre-proline 0 N--CA 1.451 -0.423 0 N-CA-C 113.925 1.083 . . . . 0.0 113.925 -178.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.542 ' CD ' ' HB1' ' A' ' 44' ' ' ALA . 7.5 Cg_endo -96.65 152.09 1.17 Allowed 'Trans proline' 0 N--CA 1.432 -2.134 0 N-CA-C 106.828 -2.028 . . . . 0.0 106.828 132.501 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.718 HD12 HD21 ' A' ' 66' ' ' LEU . 62.1 mt -106.23 100.69 11.15 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.695 0 C-N-CA 119.566 -0.853 . . . . 0.0 110.092 -173.802 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -82.4 117.0 22.13 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.711 178.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.506 HG11 HG23 ' A' ' 50' ' ' ILE . 31.1 m -137.4 172.51 14.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.04 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.538 ' HB3' ' HB2' ' A' ' 39' ' ' ARG . 42.9 tt0 -123.18 123.02 39.85 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 176.121 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.7 p -85.14 -30.79 23.7 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.795 -173.091 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 46.8 ttp180 -174.17 -46.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.861 0.362 . . . . 0.0 110.862 179.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 21.9 mt-30 -134.37 -27.13 1.39 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.747 -175.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.8 t -125.8 160.64 29.3 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.852 0.358 . . . . 0.0 111.016 -176.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.3 m -86.08 142.93 28.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.276 177.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 10.3 tt -137.96 145.24 41.75 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.086 -178.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.528 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -121.74 143.51 49.33 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.414 179.054 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.2 pp -150.87 176.55 10.98 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 -178.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -96.42 156.15 16.46 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.477 0.655 . . . . 0.0 111.704 -177.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.558 ' HD3' ' OD1' ' A' ' 48' ' ' ASP . 28.0 ptt-85 -65.11 -33.61 76.43 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.664 179.266 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -55.43 -43.95 75.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.28 176.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -68.47 -39.46 81.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.555 177.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.908 HD13 HD13 ' A' ' 71' ' ' LEU . 18.6 tp -65.45 -29.04 69.67 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.987 -179.541 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.65 -15.91 63.67 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.84 178.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 93.5 mt -96.92 -3.72 41.31 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.697 178.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.2 mt -110.3 130.0 55.63 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.133 178.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 31.4 m -92.1 116.41 28.91 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.348 0.594 . . . . 0.0 110.416 177.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.908 HD13 HD13 ' A' ' 66' ' ' LEU . 77.2 mt -108.57 144.77 35.82 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.102 -176.449 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.401 HG23 ' HB2' ' A' ' 11' ' ' ARG . 15.9 m -132.33 119.23 16.37 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.505 170.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -63.5 163.15 24.9 Favored 'Trans proline' 0 C--O 1.237 0.473 0 C-N-CA 122.209 1.939 . . . . 0.0 112.293 -178.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.409 ' CD1' ' HB2' ' A' ' 9' ' ' SER . 61.0 mt -65.68 -30.4 71.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.335 173.325 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 . . . . . 0 C--O 1.251 1.132 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.779 178.443 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 mpt? . . . . . 0 N--CA 1.482 1.137 0 CA-C-O 120.551 0.215 . . . . 0.0 111.46 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.9 t -76.3 104.09 6.65 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.031 0.443 . . . . 0.0 109.9 178.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -131.94 146.75 52.28 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.657 -178.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 95.0 mt 52.4 72.68 0.39 Allowed 'General case' 0 C--N 1.329 -0.298 0 O-C-N 124.119 0.887 . . . . 0.0 113.192 179.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -113.41 92.23 22.52 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 168.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -77.17 117.56 4.45 Favored 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 122.849 2.366 . . . . 0.0 113.051 -173.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.5 m -73.2 -37.81 66.34 Favored 'General case' 0 N--CA 1.44 -0.964 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.446 175.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.6 mtt180 -155.18 157.13 36.91 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.499 -178.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.522 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 39.1 m -122.57 130.27 52.83 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.837 -1.074 . . . . 0.0 108.513 170.118 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -110.5 142.03 42.83 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.373 -177.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 12.9 ptt180 -108.05 148.67 29.45 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.303 0.573 . . . . 0.0 110.493 177.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.551 HG12 ' CD2' ' A' ' 71' ' ' LEU . 22.4 mt -90.2 113.34 26.12 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.618 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 10.5 t -91.13 -11.04 39.72 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.744 -0.382 . . . . 0.0 111.143 -178.062 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.652 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 161.36 -168.47 36.6 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.343 -0.932 . . . . 0.0 112.211 177.295 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -98.54 157.06 16.47 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 177.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.4 t -59.24 140.16 87.9 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.642 175.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -65.17 -14.57 45.85 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.271 1.981 . . . . 0.0 111.596 175.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -102.69 12.66 36.0 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.14 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.483 HG13 HD23 ' A' ' 68' ' ' LEU . 12.3 tt -76.27 146.24 9.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.126 0.489 . . . . 0.0 111.006 -177.556 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.572 ' HB2' ' HD2' ' A' ' 23' ' ' TYR . 20.4 m -84.03 145.61 28.4 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.861 175.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -57.25 -43.08 82.66 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.021 0.378 . . . . 0.0 112.021 -175.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -67.51 -35.83 87.4 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.24 -179.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.572 ' HD2' ' HB2' ' A' ' 20' ' ' SER . 19.2 m-85 -67.49 -35.3 78.88 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 122.847 -0.208 . . . . 0.0 110.776 177.688 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 74.2 ttt-85 -62.55 -40.25 96.24 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 174.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -66.59 -40.67 88.99 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.704 177.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 52.9 ttt180 -61.29 -45.46 94.4 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.345 176.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 23' ' ' TYR . 66.9 mt -65.95 -42.84 89.48 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.604 -178.139 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -60.83 -43.32 98.42 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.949 178.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 59.2 m -66.78 -29.59 69.57 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.381 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 84.2 mtp -77.91 -18.11 56.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.037 177.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 103.38 15.01 24.42 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.374 178.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.567 HD13 HD12 ' A' ' 69' ' ' LEU . 92.3 mt -100.93 97.94 8.47 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.008 0.432 . . . . 0.0 110.117 -179.52 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -132.9 159.2 73.56 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.133 -177.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.652 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 37.1 Cg_exo -60.47 128.58 26.48 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.653 2.236 . . . . 0.0 111.455 176.361 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 115.37 -12.73 18.92 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 120.668 -0.777 . . . . 0.0 111.891 -176.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.496 ' HB3' HD13 ' A' ' 12' ' ' ILE . . . -89.41 176.47 6.9 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-O 121.329 0.585 . . . . 0.0 110.09 179.156 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -147.19 150.65 35.32 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.134 -177.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 55.3 mt -127.53 131.34 50.07 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.66 177.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -107.67 127.69 53.89 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.704 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 14.7 p -62.17 124.72 17.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.174 0.511 . . . . 0.0 111.592 -176.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 85.1 t -97.26 -52.92 8.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.696 173.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 38.6 mtp-105 -151.54 157.01 41.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.137 179.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.461 HG12 HG21 ' A' ' 50' ' ' ILE . 64.9 mt -127.65 131.87 69.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 176.252 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.433 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -65.13 141.41 98.28 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.384 178.565 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 32.0 Cg_exo -59.24 -16.0 31.9 Favored 'Trans proline' 0 N--CA 1.476 0.48 0 C-N-CA 123.259 2.639 . . . . 0.0 113.65 -174.588 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.414 HD22 ' N ' ' A' ' 46' ' ' LEU . 2.2 mm? -89.12 -16.98 30.16 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.702 0.287 . . . . 0.0 111.202 -177.563 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.72 -16.86 60.39 Favored Glycine 0 N--CA 1.454 -0.125 0 N-CA-C 111.016 -0.833 . . . . 0.0 111.016 -174.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.94 ' HB3' ' HD2' ' A' ' 49' ' ' PRO . 1.5 m-20 -65.62 170.6 4.56 Favored Pre-proline 0 C--N 1.326 -0.448 0 C-N-CA 123.601 0.761 . . . . 0.0 110.616 173.346 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.94 ' HD2' ' HB3' ' A' ' 48' ' ' ASP . 23.3 Cg_exo -19.77 151.38 0.0 OUTLIER 'Trans proline' 0 C--N 1.366 1.459 1 C-N-CA 126.675 4.917 . . . . 0.0 117.434 -163.693 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.486 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 62.3 mt -123.6 138.8 52.18 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 CA-C-N 113.862 -1.517 . . . . 0.0 110.604 -166.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 27.8 mp0 -86.04 119.35 26.25 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 175.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 28.3 m -130.83 159.11 43.11 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.824 -176.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -116.41 141.83 47.66 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 -178.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.434 ' O ' ' HB2' ' A' ' 55' ' ' ARG . 35.4 p -97.69 -45.15 6.48 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.356 0.598 . . . . 0.0 109.879 179.438 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.434 ' HB2' ' O ' ' A' ' 54' ' ' THR . 0.0 OUTLIER 167.66 -46.46 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 114.508 -1.224 . . . . 0.0 107.971 -173.238 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.53 -54.91 2.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.0 -175.706 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.9 t -126.86 144.34 51.01 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.041 -172.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 9.9 m -91.62 139.27 30.86 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.643 -178.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.7 mp -121.14 168.91 11.06 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.789 -178.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.486 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -142.18 124.9 15.93 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.321 175.019 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.538 ' HB2' ' HB2' ' A' ' 65' ' ' ASP . 3.5 pp -126.56 146.66 50.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.642 -173.119 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.7 ' HG3' ' HG3' ' A' ' 49' ' ' PRO . 1.0 OUTLIER -86.97 178.04 7.06 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.555 -175.172 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 44.5 mtt180 -54.73 -39.35 68.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.764 174.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.48 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 84.2 tttt -61.76 -50.68 71.39 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.86 179.053 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.538 ' HB2' ' HB2' ' A' ' 61' ' ' LEU . 24.8 m-20 -64.67 -40.05 94.73 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.928 -178.23 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 49.7 tp -59.96 -43.43 95.05 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.07 177.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.9 -13.93 62.2 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -177.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.483 HD23 HG13 ' A' ' 19' ' ' ILE . 97.3 mt -80.11 -28.05 39.09 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.723 0.297 . . . . 0.0 110.607 178.14 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.567 HD12 HD13 ' A' ' 32' ' ' LEU . 96.0 mt -104.71 140.86 37.45 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.414 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.9 m -92.11 113.12 25.3 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 170.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.551 ' CD2' HG12 ' A' ' 12' ' ' ILE . 89.6 mt -113.28 133.4 55.12 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.608 -174.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 17.1 m -129.71 142.02 43.86 Favored Pre-proline 0 C--N 1.316 -0.855 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.561 174.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -67.87 163.24 36.28 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 121.764 1.643 . . . . 0.0 111.416 179.38 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 9' ' ' SER . 75.4 mt -59.02 -63.38 1.32 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.741 175.542 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.06 -0.972 . . . . 0.0 110.007 178.965 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.2 ttt . . . . . 0 N--CA 1.48 1.048 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.1 p -109.38 103.81 12.8 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.925 0.393 . . . . 0.0 110.632 178.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -121.96 76.83 1.32 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.247 0.546 . . . . 0.0 109.533 175.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.864 ' HG ' HG13 ' A' ' 41' ' ' VAL . 6.5 mp -107.92 154.34 21.74 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.924 -175.754 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -146.97 83.69 7.84 Favored Pre-proline 0 C--N 1.322 -0.628 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.037 172.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_exo -65.67 155.54 68.55 Favored 'Trans proline' 0 N--CA 1.463 -0.284 0 C-N-CA 122.984 2.456 . . . . 0.0 112.689 -173.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.8 t -133.49 -69.39 0.55 Allowed 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 176.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 54.4 mtt180 -147.12 175.22 10.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.013 0.435 . . . . 0.0 110.611 176.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.1 t -114.17 135.67 53.79 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 174.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -119.92 146.58 45.66 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 -174.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.459 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 2.5 ptp180 -104.09 147.17 27.72 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.133 0.492 . . . . 0.0 110.424 178.543 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.559 HG13 ' O ' ' A' ' 36' ' ' ALA . 46.9 mt -86.28 113.39 24.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.797 178.055 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 3.5 m -68.4 -35.3 77.45 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.266 0.555 . . . . 0.0 110.146 178.26 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.421 ' HA2' ' HB3' ' A' ' 34' ' ' PRO . . . 159.15 -153.25 24.34 Favored Glycine 0 N--CA 1.44 -1.087 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.112 -178.394 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -100.5 151.62 21.35 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 120.908 0.385 . . . . 0.0 110.098 179.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.9 t -72.14 140.06 82.6 Favored Pre-proline 0 C--N 1.317 -0.833 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.557 176.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_exo -57.92 -21.03 47.32 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.664 2.243 . . . . 0.0 112.407 179.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.14 16.06 15.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.514 -177.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.475 ' HA ' HD22 ' A' ' 68' ' ' LEU . 15.7 tt -72.23 154.76 7.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.691 0.281 . . . . 0.0 110.412 179.34 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 21.6 t -84.05 143.78 29.51 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.875 0.369 . . . . 0.0 110.683 -178.051 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -64.3 132.33 49.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.472 178.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.98 -33.69 3.73 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 121.047 -0.596 . . . . 0.0 111.754 -177.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 61.4 t80 -65.83 -35.84 81.81 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.369 0.604 . . . . 0.0 109.539 176.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 24' ' ' ARG . 12.3 ttm180 -58.83 -43.11 90.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.047 174.087 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -66.1 -36.5 83.33 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.699 -179.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.419 ' O ' ' HG3' ' A' ' 30' ' ' MET . 39.4 ttm180 -67.93 -40.4 83.35 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.298 176.59 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.555 HD12 HD21 ' A' ' 69' ' ' LEU . 64.2 mt -65.04 -43.68 91.54 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.258 179.248 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -58.1 -46.47 85.48 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.224 175.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.8 t -61.16 -32.86 72.59 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.344 -0.843 . . . . 0.0 110.886 179.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.419 ' HG3' ' O ' ' A' ' 26' ' ' ARG . 89.4 mtp -74.65 -22.16 59.04 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.863 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 109.04 16.56 11.21 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.592 -0.813 . . . . 0.0 112.342 178.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.443 HD12 HD12 ' A' ' 69' ' ' LEU . 81.9 mt -104.04 96.96 7.01 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 178.797 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.471 ' HB2' ' HD2' ' A' ' 34' ' ' PRO . 1.8 pt? -135.67 161.09 64.98 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.342 -177.124 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.471 ' HD2' ' HB2' ' A' ' 33' ' ' LEU . 19.8 Cg_endo -59.8 131.43 39.8 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.43 2.087 . . . . 0.0 111.138 174.681 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.28 9.37 39.08 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.546 -0.835 . . . . 0.0 112.244 -178.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.559 ' O ' HG13 ' A' ' 12' ' ' ILE . . . -111.9 125.63 54.24 Favored 'General case' 0 N--CA 1.445 -0.72 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 177.35 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.459 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -99.75 138.69 36.48 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 121.12 0.486 . . . . 0.0 111.263 178.167 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 64.1 mt -119.44 141.63 48.95 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.396 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.482 ' HD3' ' HB3' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -99.32 154.08 18.46 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 173.607 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 12.5 p -95.97 128.54 47.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-O 121.314 0.578 . . . . 0.0 110.871 -177.045 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.864 HG13 ' HG ' ' A' ' 4' ' ' LEU . 92.8 t -88.06 -52.22 11.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.538 175.607 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 50.5 mtp180 -158.25 136.4 10.79 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.699 179.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.2 mp -96.73 129.51 46.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 172.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.427 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -69.38 131.28 90.26 Favored Pre-proline 0 C--N 1.324 -0.505 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 176.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 20.1 Cg_exo -66.36 4.58 0.94 Allowed 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 123.053 2.502 . . . . 0.0 113.089 -176.026 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -101.29 -23.67 14.36 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.48 179.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 97.91 -15.9 61.02 Favored Glycine 0 N--CA 1.453 -0.182 0 N-CA-C 110.536 -1.026 . . . . 0.0 110.536 -171.388 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.622 ' CB ' ' HD2' ' A' ' 49' ' ' PRO . 0.6 OUTLIER -64.85 170.29 4.25 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 114.488 -0.856 . . . . 0.0 109.888 170.901 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.645 ' HD3' ' HD3' ' A' ' 62' ' ' ARG . 3.0 Cg_exo -30.75 151.1 0.02 OUTLIER 'Trans proline' 0 C--N 1.361 1.21 0 C-N-CA 125.197 3.931 . . . . 0.0 116.395 -164.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 74.2 mt -121.2 133.34 68.1 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 CA-C-N 113.939 -1.482 . . . . 0.0 109.784 -172.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -79.41 114.37 18.29 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 177.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 35.4 m -121.26 177.55 3.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 179.036 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.482 ' HB3' ' HD3' ' A' ' 39' ' ' ARG . 0.9 OUTLIER -138.66 140.36 38.82 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 -178.119 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 12.6 m -115.0 -32.52 5.72 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 112.219 0.451 . . . . 0.0 112.219 -171.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.583 ' HG3' ' HG2' ' A' ' 56' ' ' GLN . 14.4 tpt180 -178.97 -39.71 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.694 0.283 . . . . 0.0 111.388 -170.483 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.583 ' HG2' ' HG3' ' A' ' 55' ' ' ARG . 14.5 mm100 -130.25 -47.65 1.09 Allowed 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -169.704 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.6 t -144.19 161.03 39.9 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 120.765 0.317 . . . . 0.0 110.91 -172.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.4 m -68.99 146.71 52.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.357 -178.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 58.9 tp -131.21 144.88 51.67 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.905 178.579 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -123.99 122.27 37.46 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.846 0.355 . . . . 0.0 110.256 178.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.468 ' O ' ' HA ' ' A' ' 49' ' ' PRO . 3.1 pp -122.44 140.15 53.05 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.039 179.67 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.645 ' HD3' ' HD3' ' A' ' 49' ' ' PRO . 19.3 mmt180 -67.12 170.06 7.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.449 0.642 . . . . 0.0 112.193 -175.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.4 ptm180 -60.88 -33.6 73.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.226 176.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -64.2 -49.29 72.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.625 175.432 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.454 ' OD1' ' HB2' ' A' ' 62' ' ' ARG . 4.3 m-20 -56.46 -40.82 75.48 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-O 121.223 0.535 . . . . 0.0 109.946 177.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 61.2 tp -58.42 -43.39 88.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.783 176.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -73.27 -12.68 60.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.551 -177.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.475 HD22 ' HA ' ' A' ' 19' ' ' ILE . 97.4 mt -96.8 -16.5 20.78 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.788 179.477 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.555 HD21 HD12 ' A' ' 27' ' ' LEU . 96.1 mt -116.15 118.94 34.22 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.894 0.378 . . . . 0.0 110.286 179.678 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.0 m -77.32 114.16 15.85 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.173 0.511 . . . . 0.0 110.049 -179.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.548 ' CD2' HG12 ' A' ' 12' ' ' ILE . 96.1 mt -118.59 127.62 53.77 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.453 -176.711 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 28.5 m -129.73 149.15 72.19 Favored Pre-proline 0 C--N 1.319 -0.74 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 174.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -65.97 163.39 31.29 Favored 'Trans proline' 0 N--CA 1.46 -0.46 0 C-N-CA 121.621 1.547 . . . . 0.0 111.398 177.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 89.3 mt -62.5 -41.87 99.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.164 0.507 . . . . 0.0 109.799 178.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 29.3 t70 . . . . . 0 C--O 1.248 0.994 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.476 175.819 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.9 tpt . . . . . 0 N--CA 1.476 0.868 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.6 m -97.0 108.07 20.73 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.126 0.489 . . . . 0.0 110.702 -177.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -138.14 85.0 2.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.095 179.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -151.08 159.39 44.53 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.429 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.6 tp60 -141.69 83.17 13.27 Favored Pre-proline 0 C--N 1.32 -0.705 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -178.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -85.54 103.29 0.76 Allowed 'Trans proline' 0 N--CA 1.448 -1.159 0 C-N-CA 122.133 1.889 . . . . 0.0 111.299 177.104 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 18.2 m -95.46 -67.91 0.83 Allowed 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.813 -177.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.459 ' O ' HG12 ' A' ' 40' ' ' VAL . 35.3 mmt180 -137.26 174.57 10.47 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 121.455 0.645 . . . . 0.0 110.782 -176.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.446 ' HB2' ' CD1' ' A' ' 74' ' ' LEU . 51.1 m -113.53 133.44 55.24 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.078 172.079 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 60.5 m-85 -111.49 127.0 55.56 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -177.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.506 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 12.8 ptt180 -98.01 149.25 22.66 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.105 0.479 . . . . 0.0 110.625 -179.443 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.541 HG12 ' CD2' ' A' ' 71' ' ' LEU . 21.8 mt -90.34 118.63 36.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.007 -178.366 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 2.2 p -90.89 -12.24 36.76 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.96 0.41 . . . . 0.0 111.231 178.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.435 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 152.69 -164.81 30.84 Favored Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.717 -0.754 . . . . 0.0 111.912 176.657 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 48.0 m-85 -97.67 150.96 20.61 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 177.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.443 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 20.6 m -68.21 140.62 93.2 Favored Pre-proline 0 C--N 1.317 -0.828 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 177.088 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 23.6 Cg_exo -64.41 -0.89 3.27 Favored 'Trans proline' 0 CA--C 1.531 0.337 0 C-N-CA 123.047 2.498 . . . . 0.0 113.39 -175.847 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -105.41 17.24 24.25 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.862 0.363 . . . . 0.0 110.913 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.51 HG13 HD23 ' A' ' 68' ' ' LEU . 11.4 tt -93.73 159.76 2.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.619 -179.505 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 21.8 m -95.92 149.92 21.01 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.627 177.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -59.04 -48.7 80.63 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.411 -178.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.53 -37.16 91.76 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.959 -0.639 . . . . 0.0 112.421 -179.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.496 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 0.1 OUTLIER -72.05 -40.0 68.67 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.546 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 56.5 ttt-85 -57.08 -44.94 83.6 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.216 0.532 . . . . 0.0 110.378 175.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -62.62 -43.42 98.84 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.429 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.47 ' HG2' ' HE1' ' A' ' 30' ' ' MET . 36.6 ttm180 -61.92 -42.47 99.13 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.309 177.596 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.701 HD23 HD12 ' A' ' 32' ' ' LEU . 78.8 mt -66.27 -44.68 82.89 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.314 -179.246 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 42.5 t80 -60.65 -44.68 96.14 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.211 -179.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 54.3 m -67.5 -28.93 68.26 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.499 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.47 ' HE1' ' HG2' ' A' ' 26' ' ' ARG . 69.5 mtm -82.7 -18.99 38.92 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.744 -179.706 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 119.17 12.2 7.06 Favored Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 120.156 -1.021 . . . . 0.0 113.546 175.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.701 HD12 HD23 ' A' ' 27' ' ' LEU . 94.3 mt -102.75 97.45 7.61 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.67 -0.492 . . . . 0.0 109.67 177.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -131.22 152.13 80.06 Favored Pre-proline 0 N--CA 1.449 -0.502 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.89 -176.214 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.435 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 23.7 Cg_exo -64.11 136.2 50.91 Favored 'Trans proline' 0 N--CA 1.463 -0.289 0 C-N-CA 122.728 2.285 . . . . 0.0 111.723 177.039 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 108.98 -14.46 34.1 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.397 -178.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.84 -179.68 7.34 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-O 121.002 0.429 . . . . 0.0 110.094 178.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.506 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -150.69 138.76 20.12 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.954 -176.629 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.505 ' HB3' ' HB ' ' A' ' 52' ' ' VAL . 1.3 mm? -109.56 127.1 54.24 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.707 177.106 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 18.6 ttm180 -94.21 114.83 27.01 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 176.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.585 ' HA ' HG12 ' A' ' 52' ' ' VAL . 5.7 p -69.77 131.5 34.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.748 0.785 . . . . 0.0 111.858 -169.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.0 t -104.13 -36.86 4.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.723 177.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.2 ttm180 -168.17 140.09 2.91 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -177.493 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.514 HD11 HG21 ' A' ' 40' ' ' VAL . 4.5 mp -118.72 135.1 60.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 164.618 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.616 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -73.99 142.9 80.12 Favored Pre-proline 0 C--N 1.319 -0.718 0 C-N-CA 120.859 -0.336 . . . . 0.0 111.132 -179.296 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -64.9 -12.96 36.9 Favored 'Trans proline' 0 CA--C 1.529 0.274 0 C-N-CA 123.063 2.509 . . . . 0.0 112.138 177.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -59.34 -27.51 65.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.066 177.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.28 -75.03 0.24 Allowed Glycine 0 CA--C 1.494 -1.226 0 N-CA-C 110.493 -1.043 . . . . 0.0 110.493 -176.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -169.49 119.18 0.58 Allowed Pre-proline 0 N--CA 1.45 -0.473 0 CA-C-O 122.333 1.064 . . . . 0.0 112.712 173.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.616 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 55.2 Cg_endo -111.85 179.69 0.04 OUTLIER 'Trans proline' 0 N--CA 1.434 -1.998 1 C-N-CA 125.874 4.383 . . . . 0.0 106.718 136.657 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.764 HG22 HG11 ' A' ' 52' ' ' VAL . 8.4 mt -133.94 105.75 7.64 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.8 0 C-N-CA 118.205 -1.398 . . . . 0.0 110.673 176.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.502 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 25.0 tp60 -86.27 113.56 22.36 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 173.589 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.764 HG11 HG22 ' A' ' 50' ' ' ILE . 16.3 m -138.44 166.18 23.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-O 120.547 0.213 . . . . 0.0 111.101 -176.097 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -120.27 122.5 41.02 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 174.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.9 m -86.07 -78.96 0.26 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.871 -177.438 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.1 ptt180 -148.24 7.82 0.8 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.196 -179.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.3 tp60 -136.38 -64.81 0.59 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.123 0.487 . . . . 0.0 110.519 -172.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.1 t -153.22 -178.61 7.07 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 -179.059 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.488 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 26.6 m -78.9 143.03 36.27 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.345 0.593 . . . . 0.0 111.142 -179.158 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.502 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 6.3 mt -131.63 170.65 14.47 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.066 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.504 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -140.62 147.21 39.01 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.821 179.366 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.47 HD22 ' HB ' ' A' ' 50' ' ' ILE . 1.3 pt? -148.92 158.33 44.09 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.865 -0.421 . . . . 0.0 109.865 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 16.1 mmt180 -100.23 173.35 6.65 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.95 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.59 -34.88 65.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.041 -179.522 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 79.2 tttt -61.71 -51.6 67.72 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.852 0.358 . . . . 0.0 110.76 177.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.443 ' HB3' ' HB2' ' A' ' 61' ' ' LEU . 3.3 t70 -65.3 -38.66 90.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.501 0.667 . . . . 0.0 109.504 -178.525 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.565 HD21 HD13 ' A' ' 50' ' ' ILE . 59.0 tp -60.42 -39.13 86.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.138 176.19 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.02 -17.26 64.36 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.969 -176.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.51 HD23 HG13 ' A' ' 19' ' ' ILE . 86.2 mt -83.45 -25.7 30.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.0 0.429 . . . . 0.0 111.005 179.354 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.676 HD12 HD11 ' A' ' 32' ' ' LEU . 88.9 mt -109.69 131.78 54.74 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.712 -176.496 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.3 m -88.37 113.59 24.12 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 175.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.541 ' CD2' HG12 ' A' ' 12' ' ' ILE . 75.4 mt -115.82 132.45 56.64 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.506 -175.363 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.411 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 34.7 m -127.73 141.26 40.5 Favored Pre-proline 0 C--N 1.32 -0.684 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 174.311 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 72' ' ' VAL . 22.8 Cg_exo -64.65 162.29 32.02 Favored 'Trans proline' 0 C--O 1.233 0.257 0 C-N-CA 121.74 1.627 . . . . 0.0 112.343 179.392 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.446 ' CD1' ' HB2' ' A' ' 9' ' ' SER . 75.2 mt -70.31 -45.49 66.15 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.511 173.649 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 32.9 t70 . . . . . 0 C--O 1.244 0.801 0 CA-C-O 118.228 -0.892 . . . . 0.0 109.764 179.015 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.8 ttm . . . . . 0 N--CA 1.481 1.117 0 N-CA-C 110.799 -0.075 . . . . 0.0 110.799 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.0 t 69.25 105.45 0.06 Allowed 'General case' 0 C--O 1.234 0.265 0 O-C-N 123.871 0.732 . . . . 0.0 109.719 -173.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -63.85 104.19 0.66 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.447 -177.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 78.3 mt -75.06 101.42 4.52 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 172.142 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.456 ' HA ' ' HD2' ' A' ' 6' ' ' PRO . 14.0 pt20 -125.47 117.59 24.91 Favored Pre-proline 0 C--N 1.322 -0.629 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 -167.225 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.535 ' HA ' ' HA ' ' A' ' 41' ' ' VAL . 18.1 Cg_endo -62.34 106.71 0.5 Allowed 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 122.0 1.8 . . . . 0.0 109.155 166.246 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 75.4 m -89.55 -90.72 0.14 Allowed 'General case' 0 N--CA 1.434 -1.236 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -165.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.2 mpt_? -101.05 153.41 19.58 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.206 0.527 . . . . 0.0 111.506 -170.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.572 ' HA ' ' HA ' ' A' ' 39' ' ' ARG . 30.8 m -104.99 131.86 51.96 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.519 177.354 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 43.5 m-85 -115.21 132.33 56.64 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 -179.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.459 ' HG3' HG23 ' A' ' 72' ' ' VAL . 25.5 ptt180 -99.54 145.97 26.91 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.066 0.46 . . . . 0.0 110.994 -177.706 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.567 HG12 ' CD2' ' A' ' 71' ' ' LEU . 18.0 mt -93.53 119.26 41.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.281 -177.455 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 7.4 p -92.83 -19.06 22.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.8 0.333 . . . . 0.0 111.577 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.418 ' HA2' ' HB3' ' A' ' 34' ' ' PRO . . . 164.82 -151.84 21.09 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.099 179.301 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -115.58 152.84 32.3 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.882 0.372 . . . . 0.0 110.281 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.513 ' O ' HG22 ' A' ' 19' ' ' ILE . 49.2 m -78.83 150.76 75.87 Favored Pre-proline 0 N--CA 1.442 -0.846 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.497 179.433 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -70.48 11.25 0.49 Allowed 'Trans proline' 0 N--CA 1.474 0.379 0 C-N-CA 123.161 2.574 . . . . 0.0 113.598 -176.061 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -106.23 1.82 26.35 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.757 0.313 . . . . 0.0 111.04 179.02 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.513 HG22 ' O ' ' A' ' 16' ' ' SER . 16.4 tt -89.28 143.18 11.71 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 CA-C-O 120.942 0.401 . . . . 0.0 110.735 -179.053 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 21.2 t -156.41 -174.87 5.14 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 -178.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 61.37 -155.88 0.35 Allowed 'General case' 0 CA--C 1.537 0.472 0 O-C-N 123.467 0.48 . . . . 0.0 109.768 179.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -90.17 23.64 20.19 Favored Glycine 0 CA--C 1.519 0.289 0 C-N-CA 120.896 -0.668 . . . . 0.0 112.034 178.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.453 ' CE1' HD13 ' A' ' 68' ' ' LEU . 6.3 t80 -68.45 -38.0 80.72 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.865 0.365 . . . . 0.0 110.486 -176.612 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 15.5 ttm180 -64.62 -38.96 92.8 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.804 178.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -69.72 -32.22 70.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.733 179.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.3 tpp180 -65.59 -44.16 87.48 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 175.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.438 HD23 HD12 ' A' ' 32' ' ' LEU . 89.2 mt -66.84 -41.97 86.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.472 179.498 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -56.29 -44.76 80.17 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.274 177.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 50.8 m -61.6 -33.35 73.75 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.25 178.105 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 85.1 mtp -82.52 -11.76 58.24 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.37 -179.133 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 94.61 11.16 57.27 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.835 -0.697 . . . . 0.0 111.946 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.438 HD12 HD23 ' A' ' 27' ' ' LEU . 86.7 mt -92.2 90.08 7.16 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.278 0.561 . . . . 0.0 109.787 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.3 pp -145.32 161.05 43.36 Favored Pre-proline 0 C--N 1.321 -0.674 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.773 -175.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.418 ' HB3' ' HA2' ' A' ' 14' ' ' GLY . 14.7 Cg_endo -58.03 128.15 27.74 Favored 'Trans proline' 0 C--O 1.235 0.351 0 C-N-CA 122.861 2.374 . . . . 0.0 112.011 177.192 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 111.96 -14.19 26.5 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.953 -0.642 . . . . 0.0 111.631 -176.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.528 ' HB3' HD11 ' A' ' 12' ' ' ILE . . . -93.13 -179.86 5.21 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-O 121.114 0.483 . . . . 0.0 110.16 178.587 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -154.97 146.5 23.14 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.694 -177.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 57.1 mt -130.89 132.77 45.35 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.805 177.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.572 ' HA ' ' HA ' ' A' ' 9' ' ' SER . 79.5 ttt180 -100.06 127.44 46.29 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.304 -0.407 . . . . 0.0 109.953 178.687 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.473 ' O ' ' HA ' ' A' ' 6' ' ' PRO . 5.1 p -66.53 120.84 14.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 121.254 0.549 . . . . 0.0 109.967 -179.37 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.83 ' HB ' ' HG2' ' A' ' 51' ' ' GLN . 43.0 t -92.62 -59.43 3.01 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.922 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.547 173.165 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 56.0 mtm180 -156.23 160.38 39.76 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.202 0.525 . . . . 0.0 112.099 -179.02 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 80.4 mt -129.62 135.11 62.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 172.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.492 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -71.84 153.79 92.97 Favored Pre-proline 0 C--N 1.327 -0.389 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -176.284 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 25.9 Cg_exo -63.61 -17.65 60.89 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 123.678 2.919 . . . . 0.0 113.499 -179.144 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 7.1 tt -46.99 -50.4 19.21 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.958 0.885 . . . . 0.0 109.985 175.374 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.92 -46.39 0.57 Allowed Glycine 0 N--CA 1.432 -1.624 0 N-CA-C 109.799 -1.321 . . . . 0.0 109.799 -172.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -174.42 117.36 0.34 Allowed Pre-proline 0 N--CA 1.449 -0.479 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 174.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.492 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 69.4 Cg_endo -115.65 -172.87 0.02 OUTLIER 'Trans proline' 0 N--CA 1.438 -1.753 1 C-N-CA 126.969 5.112 . . . . 0.0 106.637 132.43 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.71 HG22 HG13 ' A' ' 52' ' ' VAL . 50.8 mt -140.81 117.15 7.55 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.446 0 C-N-CA 118.866 -1.134 . . . . 0.0 111.24 175.898 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.83 ' HG2' ' HB ' ' A' ' 41' ' ' VAL . 32.4 tt0 -96.55 118.32 32.79 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.051 -0.977 . . . . 0.0 108.492 174.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.71 HG13 HG22 ' A' ' 50' ' ' ILE . 15.4 m -135.81 165.9 28.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.393 0.616 . . . . 0.0 112.212 -176.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -112.91 126.14 55.14 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.06 175.527 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.4 t -82.85 -28.33 30.18 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.04 178.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.49 -43.42 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 114.982 -1.008 . . . . 0.0 108.644 177.471 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -130.21 -37.1 1.47 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.705 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.7 t -106.83 158.76 16.75 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.738 -177.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.413 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 15.3 m -101.82 157.53 16.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.67 -177.26 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.505 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 8.7 mt -135.71 163.82 29.29 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.061 0.458 . . . . 0.0 111.465 179.121 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.563 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -140.73 135.51 31.63 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.333 175.098 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -159.49 178.65 9.67 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 -175.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.438 ' HD3' ' HA ' ' A' ' 62' ' ' ARG . 9.8 mmt85 -109.43 169.1 8.92 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.7 0.762 . . . . 0.0 112.299 179.516 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.1 ptp180 -60.81 -37.55 82.39 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.181 -1.372 . . . . 0.0 112.328 -174.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -59.81 -46.56 88.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.164 0.507 . . . . 0.0 110.678 178.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -66.48 -37.08 84.31 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.159 -176.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.564 HD21 ' CD1' ' A' ' 50' ' ' ILE . 4.6 tp -71.4 -38.71 71.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.692 176.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.07 -21.94 65.86 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.727 -0.669 . . . . 0.0 112.121 -175.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.453 HD13 ' CE1' ' A' ' 23' ' ' TYR . 60.5 mt -79.2 -12.71 59.97 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.456 -0.497 . . . . 0.0 110.555 177.144 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.402 HD12 HD11 ' A' ' 32' ' ' LEU . 82.2 mt -97.09 138.03 35.23 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 171.85 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 17.7 m -88.4 113.87 24.44 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 173.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.567 ' CD2' HG12 ' A' ' 12' ' ' ILE . 77.3 mt -116.86 134.1 55.19 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.907 -175.28 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.459 HG23 ' HG3' ' A' ' 11' ' ' ARG . 29.4 m -125.51 138.92 32.77 Favored Pre-proline 0 C--N 1.317 -0.825 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 172.026 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -65.04 165.02 22.89 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 121.669 1.579 . . . . 0.0 111.286 177.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 9' ' ' SER . 89.6 mt -51.9 -31.59 29.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.525 174.815 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 38.2 t70 . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.524 -0.751 . . . . 0.0 110.654 178.655 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 93.8 mtp . . . . . 0 N--CA 1.485 1.308 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.1 p -69.22 89.63 0.47 Allowed 'General case' 0 C--O 1.235 0.307 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -176.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.501 ' HA ' ' HD3' ' A' ' 42' ' ' ARG . . . 67.0 140.42 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.555 0.742 . . . . 0.0 112.635 177.043 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.506 ' HG ' ' H ' ' A' ' 5' ' ' GLN . 10.0 tp 57.57 -147.45 0.52 Allowed 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.234 179.496 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.506 ' H ' ' HG ' ' A' ' 4' ' ' LEU . 61.0 tt0 65.88 70.99 0.51 Allowed Pre-proline 0 N--CA 1.463 0.212 0 CA-C-O 121.483 0.659 . . . . 0.0 110.012 -173.356 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.737 ' HB2' HG11 ' A' ' 40' ' ' VAL . 85.2 Cg_endo -98.3 170.08 0.65 Allowed 'Trans proline' 0 N--CA 1.447 -1.234 0 C-N-CA 123.269 2.646 . . . . 0.0 112.879 -178.76 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.52 ' O ' ' HG3' ' A' ' 8' ' ' ARG . 36.5 t -91.3 -87.95 0.19 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.77 174.485 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.52 ' HG3' ' O ' ' A' ' 7' ' ' SER . 39.1 mtp85 -155.36 153.12 29.98 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 179.758 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.486 ' HB2' ' CD1' ' A' ' 74' ' ' LEU . 52.1 m -63.24 146.1 54.12 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.252 0.549 . . . . 0.0 111.058 -177.255 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -117.27 125.2 50.72 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.996 -177.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.544 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 26.2 ptt180 -95.01 154.18 17.29 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.069 0.461 . . . . 0.0 110.716 -178.217 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.487 HG12 ' CD2' ' A' ' 71' ' ' LEU . 18.4 mt -94.89 119.45 42.94 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.117 -177.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 4.5 p -94.46 -17.86 22.06 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.637 0.256 . . . . 0.0 111.254 179.012 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.996 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 161.32 -161.12 32.8 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.44 -0.886 . . . . 0.0 112.283 177.805 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 65.8 m-85 -110.47 156.39 20.92 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.605 -0.516 . . . . 0.0 109.605 177.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.477 ' O ' HG23 ' A' ' 19' ' ' ILE . 49.1 m -72.77 132.17 83.45 Favored Pre-proline 0 N--CA 1.442 -0.838 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 174.376 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -63.82 2.53 0.99 Allowed 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 123.325 2.683 . . . . 0.0 113.746 -174.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.01 -9.31 37.26 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.018 177.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.692 HD11 ' HB3' ' A' ' 68' ' ' LEU . 11.8 tt -84.49 143.54 11.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.107 0.48 . . . . 0.0 110.784 -178.247 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 41.2 m -84.12 158.24 21.45 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.354 177.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -63.74 -37.5 87.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.537 -173.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.46 ' O ' ' HB2' ' A' ' 25' ' ' GLN . . . -64.08 -41.27 98.55 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.679 -178.052 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -75.51 -32.87 60.67 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 178.427 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 40.3 ttt-85 -58.58 -35.39 72.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.437 172.469 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.46 ' HB2' ' O ' ' A' ' 22' ' ' GLY . 21.0 mt-30 -65.12 -33.5 76.17 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.621 177.231 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.6 tmm_? -66.01 -41.32 91.14 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.089 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 96.2 mt -69.1 -44.67 71.99 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.447 178.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -59.4 -43.94 92.91 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.83 179.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.4 m -63.59 -32.95 74.57 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.935 178.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 77.5 mtp -77.5 -15.82 59.08 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.094 178.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 95.29 15.87 42.68 Favored Glycine 0 N--CA 1.446 -0.681 0 C-N-CA 120.877 -0.678 . . . . 0.0 111.93 178.612 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.433 HD12 HD11 ' A' ' 69' ' ' LEU . 90.8 mt -92.69 79.44 4.79 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.62 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.6 pp -132.97 162.08 59.79 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.98 -173.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.996 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 35.2 Cg_exo -58.46 122.07 11.04 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.785 2.323 . . . . 0.0 112.119 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.46 -17.05 9.69 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.344 -179.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -94.6 -176.11 3.81 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 177.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.544 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -157.34 138.95 13.97 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.957 -177.633 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.433 ' N ' HD21 ' A' ' 38' ' ' LEU . 2.5 mm? -99.65 135.8 40.53 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 176.142 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.449 HH11 ' HD2' ' A' ' 39' ' ' ARG . 21.8 ttt180 -96.18 111.24 23.35 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.834 -178.423 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.737 HG11 ' HB2' ' A' ' 6' ' ' PRO . 7.8 p -60.48 127.08 19.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.438 0.637 . . . . 0.0 111.495 -177.424 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 49.6 t -103.55 -55.2 5.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.472 173.136 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.501 ' HD3' ' HA ' ' A' ' 3' ' ' ALA . 48.4 mtm180 -152.33 168.09 26.54 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.87 179.47 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.418 HG13 HG21 ' A' ' 50' ' ' ILE . 4.7 mp -124.49 139.37 50.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 174.049 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.45 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -68.82 135.29 89.99 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 120.633 0.254 . . . . 0.0 110.461 178.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 23.9 Cg_exo -65.74 -1.57 5.18 Favored 'Trans proline' 0 N--CA 1.475 0.419 0 C-N-CA 123.117 2.545 . . . . 0.0 113.195 -178.315 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -94.38 -16.94 23.03 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.812 179.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.472 ' O ' ' HD2' ' A' ' 63' ' ' ARG . . . 91.88 -9.53 76.5 Favored Glycine 0 N--CA 1.454 -0.15 0 N-CA-C 110.417 -1.073 . . . . 0.0 110.417 -171.178 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.899 ' HB3' ' HD2' ' A' ' 49' ' ' PRO . 6.5 m-20 -74.2 171.55 10.88 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 114.022 -1.089 . . . . 0.0 110.285 174.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.899 ' HD2' ' HB3' ' A' ' 48' ' ' ASP . 14.4 Cg_exo -24.43 152.13 0.0 OUTLIER 'Trans proline' 0 C--N 1.362 1.289 1 C-N-CA 126.316 4.678 . . . . 0.0 117.291 -167.665 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.5 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 71.0 mt -109.89 138.3 38.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-N 113.638 -1.619 . . . . 0.0 109.602 -171.345 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -86.72 108.92 18.89 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 35.8 m -121.18 -179.43 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.483 ' HA ' ' HA ' ' A' ' 58' ' ' SER . 34.0 tt0 -136.87 134.36 36.79 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 179.648 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.0 p -84.07 -45.86 12.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.325 0.583 . . . . 0.0 110.317 -177.105 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 28.8 ttm180 -161.8 -59.19 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.331 -0.849 . . . . 0.0 108.98 177.038 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -111.3 -39.27 4.75 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.308 177.914 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.8 t -103.06 149.87 24.15 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.912 0.387 . . . . 0.0 111.135 -172.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.483 ' HA ' ' HA ' ' A' ' 53' ' ' GLU . 21.3 m -95.17 152.09 18.65 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.576 179.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 53.1 tp -143.17 146.82 34.05 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.897 -177.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.5 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -112.28 124.82 53.3 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.95 176.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.655 HD13 HD11 ' A' ' 66' ' ' LEU . 1.3 pp -109.66 125.63 52.82 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.066 0.46 . . . . 0.0 110.584 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.435 ' HG3' ' HG3' ' A' ' 49' ' ' PRO . 2.9 mpt_? -67.24 171.98 5.24 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.068 -177.743 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.472 ' HD2' ' O ' ' A' ' 47' ' ' GLY . 0.0 OUTLIER -67.27 -44.52 79.13 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.589 179.445 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 60.0 tttp -70.71 -40.37 72.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.972 0.415 . . . . 0.0 110.324 177.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -63.75 -35.23 79.88 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.967 178.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.655 HD11 HD13 ' A' ' 61' ' ' LEU . 40.7 tp -68.81 -38.13 79.71 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.561 174.468 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.01 -15.43 63.02 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.903 -176.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.692 ' HB3' HD11 ' A' ' 19' ' ' ILE . 72.0 mt -83.87 -24.75 30.73 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.011 0.434 . . . . 0.0 110.751 177.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.433 HD11 HD12 ' A' ' 32' ' ' LEU . 87.8 mt -102.81 141.77 35.06 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.446 179.652 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.1 m -96.42 113.42 25.0 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 170.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.487 ' CD2' HG12 ' A' ' 12' ' ' ILE . 51.7 mt -121.19 137.1 54.83 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.628 -176.263 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 34.6 m -132.36 150.24 75.37 Favored Pre-proline 0 C--N 1.321 -0.653 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 174.053 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -60.21 163.75 13.95 Favored 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 121.863 1.708 . . . . 0.0 111.716 177.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.486 ' CD1' ' HB2' ' A' ' 9' ' ' SER . 74.8 mt -66.22 -12.17 54.48 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.022 175.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.3 t70 . . . . . 0 C--O 1.249 1.033 0 O-C-N 124.285 0.991 . . . . 0.0 110.311 -178.095 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 35.3 t . . . . . 0 N--CA 1.454 -0.27 0 CA-C-O 121.203 0.525 . . . . 0.0 109.87 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.464 ' O ' HG12 ' A' ' 40' ' ' VAL . 54.0 mtt180 -145.72 159.65 42.86 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.425 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.418 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 69.4 m -120.82 133.92 55.3 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.717 173.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.554 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 56.6 m-85 -114.35 129.21 56.64 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.666 -177.52 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.561 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 85.0 mtt180 -92.38 157.9 16.36 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.0 0.429 . . . . 0.0 110.692 178.814 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 51.8 mt -95.74 104.79 16.23 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 173.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.579 ' HB ' HG22 ' A' ' 72' ' ' VAL . 2.9 t -81.94 -14.61 55.86 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.128 0.49 . . . . 0.0 110.444 -175.631 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.731 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 157.93 -163.68 32.86 Favored Glycine 0 N--CA 1.442 -0.956 0 C-N-CA 120.886 -0.674 . . . . 0.0 112.038 179.308 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -97.71 153.38 18.28 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 88.7 p -74.38 162.17 74.95 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.869 -179.619 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_exo -71.39 -12.64 29.88 Favored 'Trans proline' 0 CA--C 1.529 0.229 0 C-N-CA 122.58 2.186 . . . . 0.0 112.095 174.664 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -89.12 -0.99 57.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.742 -178.128 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.455 HD11 ' CA ' ' A' ' 24' ' ' ARG . 18.6 tt -65.6 124.92 21.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.984 0.421 . . . . 0.0 110.017 179.597 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.5 m -138.77 159.35 42.34 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.848 -0.341 . . . . 0.0 111.876 -172.686 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 64.1 t30 60.46 41.19 16.22 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 115.549 -0.75 . . . . 0.0 112.687 168.487 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 70.19 21.97 77.28 Favored Glycine 0 C--N 1.331 0.261 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.988 174.845 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.516 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -65.88 -23.18 66.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.729 0.265 . . . . 0.0 111.294 179.823 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.455 ' CA ' HD11 ' A' ' 19' ' ' ILE . 6.0 ttm-85 -59.61 -36.3 76.05 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 121.342 0.592 . . . . 0.0 109.507 176.828 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -69.24 -36.42 77.16 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.781 179.619 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 25.2 tpp180 -67.01 -42.22 85.33 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 176.22 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 23' ' ' TYR . 84.1 mt -66.15 -43.13 87.87 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.232 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -61.55 -41.36 97.24 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.175 0.512 . . . . 0.0 110.242 178.605 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 63.3 m -60.47 -35.69 76.5 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.801 175.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 71.4 mtm -84.29 -11.52 56.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.613 -178.002 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 93.55 27.72 12.56 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.911 -0.662 . . . . 0.0 112.662 177.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.61 HD13 HD11 ' A' ' 69' ' ' LEU . 94.5 mt -105.74 102.77 12.2 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.083 0.468 . . . . 0.0 110.573 178.852 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.413 ' N ' HD23 ' A' ' 33' ' ' LEU . 1.8 pt? -138.02 157.11 73.63 Favored Pre-proline 0 N--CA 1.448 -0.574 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.225 -179.35 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.731 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 28.6 Cg_exo -62.13 136.8 62.6 Favored 'Trans proline' 0 C--O 1.233 0.275 0 C-N-CA 122.573 2.182 . . . . 0.0 111.92 178.05 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 114.69 -17.74 17.85 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.323 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -86.03 175.99 8.27 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-O 121.046 0.451 . . . . 0.0 110.215 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.561 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -148.56 148.18 29.88 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.045 -177.151 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 49.0 mt -122.7 130.24 52.72 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.084 178.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 14.5 ttm180 -98.13 119.6 37.07 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.41 178.503 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.491 ' HA ' HG12 ' A' ' 52' ' ' VAL . 13.4 p -61.3 127.3 20.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -171.868 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.439 ' O ' ' HB3' ' A' ' 42' ' ' ARG . 76.1 t -98.0 -54.66 6.75 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 165.816 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.439 ' HB3' ' O ' ' A' ' 41' ' ' VAL . 15.9 ptt180 173.3 156.14 0.11 Allowed 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.359 0.6 . . . . 0.0 111.944 174.67 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.401 HG23 ' O ' ' A' ' 49' ' ' PRO . 84.4 mt -118.15 142.27 33.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 170.08 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.67 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -74.81 134.04 75.67 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-O 120.501 0.191 . . . . 0.0 110.556 176.806 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -66.8 -19.86 52.66 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 123.233 2.622 . . . . 0.0 112.999 -174.86 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 46' ' ' LEU . 4.0 mm? -51.48 -44.85 62.58 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.567 0.699 . . . . 0.0 110.509 176.541 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -174.97 -74.16 0.05 OUTLIER Glycine 0 N--CA 1.431 -1.651 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.328 -177.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.508 ' OD1' ' HD3' ' A' ' 63' ' ' ARG . 6.8 p-10 -177.97 127.16 0.28 Allowed Pre-proline 0 N--CA 1.442 -0.858 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 -179.088 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.67 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 73.5 Cg_endo -114.28 -168.2 0.02 OUTLIER 'Trans proline' 0 N--CA 1.43 -2.236 0 C-N-CA 124.482 3.455 . . . . 0.0 106.569 129.295 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.743 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 58.6 mt -145.1 99.9 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.35 0 C-N-CA 119.93 -0.708 . . . . 0.0 109.432 170.781 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.417 ' HA ' ' OE1' ' A' ' 51' ' ' GLN . 14.2 mm-40 -86.41 121.45 28.98 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 174.456 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.491 HG12 ' HA ' ' A' ' 40' ' ' VAL . 9.5 m -142.22 172.76 8.48 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.927 -179.047 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -122.22 150.82 41.75 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 177.078 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 29.3 p -120.11 -30.46 4.66 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -173.722 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 27.2 tpt180 178.61 -54.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.864 -175.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -143.82 4.79 1.32 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.568 -179.19 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.9 t -149.93 138.73 20.91 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.234 0.54 . . . . 0.0 111.063 -175.861 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.1 p -80.22 148.78 30.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.402 -178.475 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.582 HD13 ' N ' ' A' ' 60' ' ' ALA . 2.4 tm? -129.56 148.73 51.49 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.22 -0.445 . . . . 0.0 109.906 -178.366 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.743 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -139.72 148.11 41.85 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.969 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.585 HD11 HD12 ' A' ' 50' ' ' ILE . 3.9 pp -162.98 -179.18 6.56 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.543 -0.539 . . . . 0.0 109.543 -179.066 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 26.0 mmm-85 -110.83 170.06 8.35 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 122.03 0.919 . . . . 0.0 112.286 -177.338 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.508 ' HD3' ' OD1' ' A' ' 48' ' ' ASP . 18.1 ptt-85 -62.98 -35.17 79.28 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 113.771 -1.559 . . . . 0.0 111.455 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -71.52 -33.95 69.64 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.015 -178.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -75.31 -36.73 61.07 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.389 0.614 . . . . 0.0 109.536 176.719 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.622 HD11 HD11 ' A' ' 71' ' ' LEU . 37.6 tp -64.38 -30.39 71.43 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.737 175.028 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.09 -9.77 48.76 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.591 -178.511 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.482 ' HB3' HD11 ' A' ' 27' ' ' LEU . 63.6 mt -91.79 -5.38 53.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.041 0.448 . . . . 0.0 110.568 175.824 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.61 HD11 HD13 ' A' ' 32' ' ' LEU . 95.8 mt -119.83 153.75 35.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.952 -178.613 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 15.8 m -113.3 121.22 43.76 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.02 -0.537 . . . . 0.0 109.577 170.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.622 HD11 HD11 ' A' ' 66' ' ' LEU . 64.8 mt -103.46 146.37 28.62 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.263 0.554 . . . . 0.0 111.578 -175.916 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.579 HG22 ' HB ' ' A' ' 13' ' ' THR . 12.3 m -129.49 117.86 18.82 Favored Pre-proline 0 C--N 1.322 -0.63 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.669 173.442 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.554 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 7.9 Cg_exo -70.95 163.02 40.67 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 121.995 1.796 . . . . 0.0 111.728 -178.416 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 9' ' ' SER . 86.7 mt -58.33 -47.95 82.1 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 172.887 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 . . . . . 0 C--O 1.25 1.116 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.72 174.685 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.516 ' HB3' ' HD3' ' A' ' 8' ' ' ARG . 22.9 t . . . . . 0 N--CA 1.452 -0.347 0 CA-C-O 121.006 0.431 . . . . 0.0 110.183 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.516 ' HD3' ' HB3' ' A' ' 7' ' ' SER . 0.0 OUTLIER -143.82 157.09 44.61 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.282 -179.864 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.424 ' HB2' ' CD1' ' A' ' 74' ' ' LEU . 15.3 m -105.1 164.13 12.04 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 176.021 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -127.87 132.84 49.33 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.865 -0.334 . . . . 0.0 110.989 -176.424 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.479 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 17.1 mtp180 -91.1 152.23 20.7 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.18 -0.464 . . . . 0.0 109.771 175.093 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.547 HG12 ' CD2' ' A' ' 71' ' ' LEU . 33.5 mt -102.9 117.62 48.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 176.495 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 2.9 p -87.34 -24.47 24.26 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.11 0.481 . . . . 0.0 110.74 177.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 165.62 -154.19 24.71 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.822 -0.704 . . . . 0.0 111.752 -179.185 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.473 ' CE1' ' HG3' ' A' ' 24' ' ' ARG . 44.9 m-85 -113.82 152.97 29.9 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 -177.016 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.435 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 20.9 m -70.35 140.21 87.47 Favored Pre-proline 0 C--N 1.319 -0.741 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.395 177.72 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 34.8 Cg_exo -61.57 -20.51 69.02 Favored 'Trans proline' 0 CA--C 1.529 0.265 0 C-N-CA 122.874 2.382 . . . . 0.0 112.22 179.524 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.68 29.24 2.37 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.933 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.521 HG13 HD22 ' A' ' 68' ' ' LEU . 19.8 tt -74.58 149.72 7.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.534 179.003 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.489 ' O ' ' HB2' ' A' ' 23' ' ' TYR . 9.3 m -89.43 117.94 28.72 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -173.153 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 24.47 88.15 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 115.407 1.632 . . . . 0.0 115.407 165.615 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.66 9.13 55.05 Favored Glycine 0 CA--C 1.517 0.176 0 N-CA-C 114.797 0.679 . . . . 0.0 114.797 171.441 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.489 ' HB2' ' O ' ' A' ' 20' ' ' SER . 0.9 OUTLIER -64.97 -23.06 67.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 117.75 0.775 . . . . 0.0 111.37 179.785 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.473 ' HG3' ' CE1' ' A' ' 15' ' ' TYR . 34.2 ttm180 -56.02 -46.58 78.75 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 121.165 0.507 . . . . 0.0 110.0 174.083 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -65.04 -34.48 78.54 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.996 -178.21 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 33.9 ttm180 -73.16 -39.85 65.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.157 178.258 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.515 HD22 HD12 ' A' ' 32' ' ' LEU . 95.3 mt -68.68 -43.57 75.84 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.26 -178.746 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -60.89 -42.44 97.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.248 179.423 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 69.9 m -67.4 -31.05 71.01 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.22 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.425 ' CE ' HD23 ' A' ' 27' ' ' LEU . 68.0 mtm -79.16 -27.67 42.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.233 179.72 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 124.48 4.51 7.52 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.32 -0.943 . . . . 0.0 112.857 177.849 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.543 HD13 HD11 ' A' ' 69' ' ' LEU . 92.1 mt -97.15 93.73 6.73 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 pp -139.05 159.05 68.38 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.615 -173.528 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.25 121.56 10.12 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.787 2.325 . . . . 0.0 112.08 177.817 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 114.74 -19.92 15.58 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 121.055 -0.593 . . . . 0.0 111.797 -176.775 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.492 ' O ' HG13 ' A' ' 12' ' ' ILE . . . -83.81 106.9 15.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.227 0.537 . . . . 0.0 110.46 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.479 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -88.58 116.33 26.75 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.772 177.33 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.49 HD13 HG21 ' A' ' 52' ' ' VAL . 70.5 mt -94.59 134.15 37.45 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.311 0.577 . . . . 0.0 110.236 -177.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 49.5 ttt180 -98.25 115.1 27.67 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.728 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.555 ' HA ' HG12 ' A' ' 52' ' ' VAL . 99.4 t -64.03 120.43 10.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 123.402 0.439 . . . . 0.0 111.275 -178.519 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.682 HG12 ' HG3' ' A' ' 42' ' ' ARG . 53.1 t -98.14 -53.56 7.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.52 174.171 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.682 ' HG3' HG12 ' A' ' 41' ' ' VAL . 25.7 mtp180 -148.46 140.12 23.66 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -173.279 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.2 mp -120.14 141.11 41.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 168.29 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.811 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -79.39 134.5 58.45 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-O 120.566 0.222 . . . . 0.0 110.868 176.347 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -64.64 -7.56 14.95 Favored 'Trans proline' 0 N--CA 1.479 0.636 0 C-N-CA 123.384 2.723 . . . . 0.0 113.159 -177.382 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.15 -37.93 81.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.593 0.711 . . . . 0.0 110.891 175.724 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.449 ' O ' ' HB2' ' A' ' 48' ' ' ASP . . . 174.3 -76.42 0.08 OUTLIER Glycine 0 N--CA 1.436 -1.332 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 -175.517 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.449 ' HB2' ' O ' ' A' ' 47' ' ' GLY . 17.2 t70 -179.58 118.37 0.22 Allowed Pre-proline 0 N--CA 1.453 -0.306 0 N-CA-C 113.658 0.985 . . . . 0.0 113.658 173.131 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.811 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 30.7 Cg_endo -111.49 160.77 0.05 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.441 1 C-N-CA 126.049 4.499 . . . . 0.0 108.835 139.309 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.667 HG22 HG13 ' A' ' 52' ' ' VAL . 2.7 mp -119.64 106.09 18.51 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.69 0 C-N-CA 118.89 -1.124 . . . . 0.0 110.028 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.535 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 0.8 OUTLIER -86.5 111.8 20.92 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 174.436 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.667 HG13 HG22 ' A' ' 50' ' ' ILE . 21.4 m -124.01 173.15 10.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.305 0.574 . . . . 0.0 111.922 -174.181 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -120.02 128.27 53.38 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.912 179.219 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.5 m -86.16 -40.01 16.08 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 173.353 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 26.2 ttp85 -179.63 -49.88 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.781 -1.099 . . . . 0.0 108.537 173.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -128.63 -24.22 3.04 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.095 174.209 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.8 t -93.12 138.95 31.08 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 121.131 0.491 . . . . 0.0 109.679 177.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 21.7 m -109.35 137.18 47.6 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.672 178.256 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.535 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 12.1 mt -123.84 152.13 42.64 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.98 -177.193 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.411 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -129.98 118.61 21.89 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 114.946 -1.025 . . . . 0.0 109.16 177.88 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.494 ' HB2' ' HB2' ' A' ' 65' ' ' ASP . 0.7 OUTLIER -124.26 150.05 45.78 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -174.74 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.574 ' N ' ' HD3' ' A' ' 62' ' ' ARG . 0.8 OUTLIER -97.89 176.43 5.79 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 120.953 0.406 . . . . 0.0 110.436 -176.154 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -54.01 -34.42 59.85 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.086 175.079 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.1 -45.72 90.14 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.981 177.382 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.494 ' HB2' ' HB2' ' A' ' 61' ' ' LEU . 5.1 m-20 -67.34 -41.68 84.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.064 178.698 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 62.1 tp -59.07 -37.82 77.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.822 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.97 -25.01 66.91 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.55 -178.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.521 HD22 HG13 ' A' ' 19' ' ' ILE . 81.8 mt -88.97 -15.83 33.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.236 -176.367 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.543 HD11 HD13 ' A' ' 32' ' ' LEU . 96.3 mt -110.33 143.2 40.91 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.965 0.412 . . . . 0.0 111.258 -175.699 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 20.4 m -101.57 114.1 27.84 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 172.496 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.547 ' CD2' HG12 ' A' ' 12' ' ' ILE . 75.0 mt -111.4 143.8 41.63 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.212 -174.517 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.497 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 16.3 m -126.37 123.77 24.24 Favored Pre-proline 0 C--N 1.317 -0.818 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.215 173.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.497 ' HD3' ' HA ' ' A' ' 72' ' ' VAL . 13.5 Cg_exo -70.01 161.48 45.82 Favored 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 122.201 1.934 . . . . 0.0 112.427 -175.407 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.424 ' CD1' ' HB2' ' A' ' 9' ' ' SER . 66.9 mt -74.89 -38.88 61.76 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.007 171.539 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.2 t70 . . . . . 0 C--O 1.25 1.096 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.211 -178.821 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 31.8 t . . . . . 0 N--CA 1.452 -0.357 0 CA-C-O 120.675 0.274 . . . . 0.0 110.496 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.451 ' H ' HG12 ' A' ' 40' ' ' VAL . 47.1 mtp180 -128.64 167.68 16.84 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 120.816 0.341 . . . . 0.0 110.91 -178.776 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.52 ' HB2' HD12 ' A' ' 74' ' ' LEU . 21.7 m -121.93 142.89 49.82 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.058 0.456 . . . . 0.0 111.621 -173.871 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.46 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 73.2 m-85 -123.11 135.71 54.49 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.001 179.222 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.512 ' HG3' HG23 ' A' ' 72' ' ' VAL . 34.5 ptt180 -107.06 154.24 21.42 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.071 0.462 . . . . 0.0 110.48 179.369 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.444 HG12 ' CD2' ' A' ' 71' ' ' LEU . 26.6 mt -99.21 114.54 37.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.624 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 12.3 t -89.51 -18.44 26.66 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.755 0.312 . . . . 0.0 110.91 -177.1 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.575 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 167.39 -168.24 40.39 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.855 -0.688 . . . . 0.0 111.569 179.775 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -102.02 155.8 17.95 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.969 0.384 . . . . 0.0 110.315 177.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.502 ' O ' HG22 ' A' ' 19' ' ' ILE . 23.5 m -76.68 145.01 74.25 Favored Pre-proline 0 N--CA 1.442 -0.854 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.598 175.169 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 26.6 Cg_exo -62.91 0.39 1.61 Allowed 'Trans proline' 0 N--CA 1.477 0.512 0 C-N-CA 123.21 2.607 . . . . 0.0 114.088 -173.804 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.94 3.63 54.74 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.764 0.316 . . . . 0.0 111.151 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.502 HG22 ' O ' ' A' ' 16' ' ' SER . 15.4 tt -84.63 124.59 39.98 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-O 121.371 0.605 . . . . 0.0 110.793 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.2 m -156.12 -176.08 5.77 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.985 -177.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 66.2 t30 64.01 29.27 14.34 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 122.949 0.5 . . . . 0.0 112.06 170.498 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 81.8 5.56 89.72 Favored Glycine 0 N--CA 1.454 -0.166 0 C-N-CA 121.13 -0.557 . . . . 0.0 113.141 176.311 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -61.4 -26.46 67.87 Favored 'General case' 0 C--N 1.33 -0.262 0 O-C-N 122.704 -0.292 . . . . 0.0 111.631 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.462 ' HA ' HD11 ' A' ' 19' ' ' ILE . 12.3 ttm180 -64.97 -40.53 95.12 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.826 0.346 . . . . 0.0 110.198 178.336 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -61.66 -43.92 97.94 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.279 178.569 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -60.65 -42.88 97.86 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.296 178.667 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 75.7 mt -70.26 -41.59 73.27 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.497 -178.641 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -60.35 -46.41 90.03 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.261 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 74.5 m -65.59 -28.35 69.07 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.588 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 69.4 mtm -85.04 -9.26 58.18 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.959 178.65 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 96.34 24.44 14.31 Favored Glycine 0 C--N 1.33 0.218 0 C-N-CA 120.932 -0.651 . . . . 0.0 112.992 174.768 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.601 HD13 HD11 ' A' ' 69' ' ' LEU . 84.8 mt -112.28 94.09 4.76 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.897 0.379 . . . . 0.0 110.196 179.387 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.401 HD23 ' N ' ' A' ' 33' ' ' LEU . 1.8 pt? -137.96 159.61 67.85 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.381 -178.004 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.575 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 17.9 Cg_exo -66.23 138.73 52.49 Favored 'Trans proline' 0 N--CA 1.464 -0.256 0 C-N-CA 122.512 2.142 . . . . 0.0 111.495 177.46 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 100.65 -1.02 55.48 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.675 -0.774 . . . . 0.0 111.863 -177.239 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -103.43 -174.76 2.62 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 176.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.438 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -159.79 151.25 19.87 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.717 -176.848 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.578 HD13 HG21 ' A' ' 52' ' ' VAL . 85.4 mt -131.86 138.48 48.47 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.618 178.714 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 -110.37 127.43 55.06 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.924 -178.6 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.451 HG12 ' H ' ' A' ' 8' ' ' ARG . 8.5 p -65.5 126.04 23.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.351 0.596 . . . . 0.0 111.216 -175.571 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.651 HG12 ' HG3' ' A' ' 42' ' ' ARG . 65.2 t -96.83 -57.72 4.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.43 -0.804 . . . . 0.0 109.587 172.363 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.651 ' HG3' HG12 ' A' ' 41' ' ' VAL . 57.3 mtp180 -146.93 158.84 44.03 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.597 -179.189 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 61.2 mt -117.71 141.26 37.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.484 ' HB3' ' O ' ' A' ' 48' ' ' ASP . . . -72.21 150.8 92.21 Favored Pre-proline 0 C--O 1.233 0.222 0 CA-C-O 120.606 0.241 . . . . 0.0 110.859 178.851 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -54.89 -18.39 16.37 Favored 'Trans proline' 0 CA--C 1.535 0.534 0 C-N-CA 123.657 2.904 . . . . 0.0 114.854 -174.549 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 77.5 mt -103.41 -31.53 9.96 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 -175.568 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 118.18 -27.99 7.12 Favored Glycine 0 N--CA 1.453 -0.178 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 -171.284 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.784 ' HB3' ' HD2' ' A' ' 49' ' ' PRO . 0.2 OUTLIER -61.16 170.32 1.67 Allowed Pre-proline 0 C--O 1.221 -0.439 0 CA-C-O 118.346 -0.835 . . . . 0.0 109.113 168.47 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.784 ' HD2' ' HB3' ' A' ' 48' ' ' ASP . 17.1 Cg_exo -18.67 150.77 0.0 OUTLIER 'Trans proline' 0 C--N 1.362 1.273 1 C-N-CA 126.582 4.855 . . . . 0.0 117.988 -153.623 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 67.0 mt -123.91 140.37 47.56 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.971 0 CA-C-N 113.579 -1.646 . . . . 0.0 110.103 -170.703 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -84.37 112.63 20.51 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 178.448 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.578 HG21 HD13 ' A' ' 38' ' ' LEU . 26.7 m -119.41 168.92 11.15 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 120.738 0.304 . . . . 0.0 110.729 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -125.83 142.61 51.43 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.025 -176.567 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 11.8 m -96.87 -59.5 1.79 Allowed 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 172.754 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -141.65 -35.22 0.46 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.175 -0.92 . . . . 0.0 109.39 176.11 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -151.21 -35.06 0.14 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.775 173.329 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 2.0 m -67.25 135.04 52.78 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.914 -178.494 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.463 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 5.6 m -96.96 133.31 41.78 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.045 176.305 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.5 mp -115.98 148.08 40.5 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.281 -179.153 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -145.56 114.15 6.78 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.904 177.083 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.552 HD11 HD13 ' A' ' 66' ' ' LEU . 2.9 pp -135.96 153.6 51.36 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.592 -178.17 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.586 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 24.2 mmt180 -64.49 166.53 8.27 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.496 0.665 . . . . 0.0 112.02 -176.057 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 56.8 mtm180 -75.06 -32.94 61.65 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.045 178.772 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -58.33 -39.8 80.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.827 173.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -75.49 -40.13 57.66 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.601 178.872 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.695 HD11 HD11 ' A' ' 71' ' ' LEU . 26.9 tp -64.12 -26.62 68.62 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.779 179.614 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.89 -19.67 65.03 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.413 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 96.1 mt -73.47 -25.06 60.31 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.959 0.409 . . . . 0.0 110.545 178.257 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.601 HD11 HD13 ' A' ' 32' ' ' LEU . 75.7 mt -98.11 130.99 44.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.168 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 27.0 m -89.25 114.29 25.62 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 174.243 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.695 HD11 HD11 ' A' ' 66' ' ' LEU . 83.0 mt -110.74 144.2 40.07 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.284 -171.33 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.512 HG23 ' HG3' ' A' ' 11' ' ' ARG . 5.1 m -136.62 135.38 20.38 Favored Pre-proline 0 C--N 1.318 -0.762 0 CA-C-N 115.045 -0.979 . . . . 0.0 109.028 171.35 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.46 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 5.4 Cg_exo -72.93 162.83 40.01 Favored 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 121.897 1.732 . . . . 0.0 112.167 -177.797 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.52 HD12 ' HB2' ' A' ' 9' ' ' SER . 74.8 mt -82.81 -36.02 25.91 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 171.002 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 34.0 t70 . . . . . 0 C--O 1.253 1.26 0 CA-C-N 114.336 -1.302 . . . . 0.0 109.234 170.714 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.457 ' HB3' HG11 ' A' ' 40' ' ' VAL . 22.8 t . . . . . 0 N--CA 1.45 -0.453 0 N-CA-C 109.789 -0.448 . . . . 0.0 109.789 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.446 ' O ' HG12 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -135.56 -179.93 5.95 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.936 0.398 . . . . 0.0 111.085 177.466 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.524 ' HB2' HD12 ' A' ' 74' ' ' LEU . 6.6 m -114.91 139.18 50.0 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.742 -177.112 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 36.3 m-85 -119.97 132.07 55.38 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.672 -178.899 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.432 ' HG3' HG23 ' A' ' 72' ' ' VAL . 1.9 ptp180 -96.68 148.72 22.59 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.025 0.441 . . . . 0.0 110.052 176.258 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.519 HD12 ' HB3' ' A' ' 36' ' ' ALA . 22.1 mt -92.91 114.3 29.45 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.14 -178.594 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 17.8 p -85.05 -22.58 28.93 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.946 0.403 . . . . 0.0 110.443 176.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 161.95 -150.35 19.65 Favored Glycine 0 N--CA 1.441 -0.972 0 C-N-CA 120.41 -0.9 . . . . 0.0 112.094 177.582 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -106.59 164.69 11.86 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 -179.465 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.416 ' HB2' ' O ' ' A' ' 67' ' ' ALA . 33.1 t -52.44 131.73 44.19 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 123.435 0.46 . . . . 0.0 110.767 175.388 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 20.7 Cg_exo -66.35 -5.01 11.67 Favored 'Trans proline' 0 C--N 1.343 0.245 0 C-N-CA 122.843 2.362 . . . . 0.0 112.243 178.711 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -122.09 26.42 8.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.71 178.598 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 18.4 tt -72.03 151.96 8.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 177.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 26.5 t -130.39 160.04 35.19 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 120.976 0.417 . . . . 0.0 111.77 -171.543 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.6 m120 63.77 -105.55 0.15 Allowed 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.923 172.695 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -148.68 27.61 1.32 Allowed Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.017 -177.252 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -65.74 -27.75 68.54 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 7.1 ttm180 -56.75 -42.64 79.68 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.383 175.468 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -68.68 -34.56 75.87 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.579 -178.326 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.1 tpp180 -61.94 -47.86 83.01 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.296 0.57 . . . . 0.0 109.749 173.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.408 HD13 HD21 ' A' ' 69' ' ' LEU . 97.8 mt -66.38 -41.77 88.91 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.53 -177.503 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -59.39 -45.22 92.06 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.558 -0.747 . . . . 0.0 110.32 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 45.9 m -65.01 -34.36 78.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.746 179.228 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.532 ' HA ' ' CE ' ' A' ' 30' ' ' MET . 10.3 mmt -73.1 -19.99 61.03 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.079 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 105.81 9.91 31.69 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.556 -0.831 . . . . 0.0 112.132 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.655 HD13 HD11 ' A' ' 69' ' ' LEU . 93.0 mt -98.52 97.94 9.19 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 178.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.8 pp -143.85 160.82 48.76 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.624 -176.274 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -60.96 133.25 46.36 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.513 2.142 . . . . 0.0 111.677 178.291 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 113.88 -17.15 20.4 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.328 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.519 ' HB3' HD12 ' A' ' 12' ' ' ILE . . . -93.27 -178.22 4.69 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-O 121.274 0.559 . . . . 0.0 110.323 179.14 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -149.1 151.88 35.19 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.287 -177.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 71.3 mt -129.24 138.17 51.51 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.211 0.529 . . . . 0.0 110.612 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 34.6 ttm180 -98.01 116.07 29.48 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.129 175.513 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.554 ' HA ' HG12 ' A' ' 52' ' ' VAL . 7.9 p -67.01 128.16 29.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.222 0.534 . . . . 0.0 110.337 -178.882 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.9 HG12 ' HG3' ' A' ' 42' ' ' ARG . 46.8 t -98.91 -53.9 7.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.243 178.066 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.9 ' HG3' HG12 ' A' ' 41' ' ' VAL . 46.3 mtt180 -157.43 138.21 13.2 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -173.816 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.6 mp -112.35 106.61 21.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 157.661 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.559 ' HB3' ' HD3' ' A' ' 49' ' ' PRO . . . -53.16 128.89 49.53 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 120.582 0.23 . . . . 0.0 111.387 -173.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -61.25 -6.41 6.6 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 123.465 2.777 . . . . 0.0 112.666 -179.266 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.443 HD13 ' HA ' ' A' ' 46' ' ' LEU . 3.7 mm? -58.82 -34.53 71.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.343 172.482 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 164.9 -76.29 0.15 Allowed Glycine 0 CA--C 1.494 -1.235 0 N-CA-C 109.862 -1.295 . . . . 0.0 109.862 -175.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -176.19 119.92 0.3 Allowed Pre-proline 0 N--CA 1.449 -0.477 0 N-CA-C 114.266 1.21 . . . . 0.0 114.266 171.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.559 ' HD3' ' HB3' ' A' ' 44' ' ' ALA . 55.2 Cg_endo -115.47 166.32 0.03 OUTLIER 'Trans proline' 0 N--CA 1.438 -1.774 1 C-N-CA 125.736 4.291 . . . . 0.0 109.159 134.869 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.604 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 59.5 mt -116.84 100.32 10.09 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.703 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.979 179.708 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.492 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 35.8 mt-30 -92.74 115.38 28.06 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.423 179.605 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.554 HG12 ' HA ' ' A' ' 40' ' ' VAL . 19.8 m -131.53 171.92 17.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.486 -177.208 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -134.63 133.62 40.33 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 17.9 m -82.95 -73.02 0.42 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.779 0.323 . . . . 0.0 111.071 -177.08 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.474 ' HD2' ' O ' ' A' ' 55' ' ' ARG . 7.4 tmm_? -167.82 23.36 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.435 ' HB2' ' O ' ' A' ' 55' ' ' ARG . 52.2 tt0 171.59 -29.76 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.553 -175.446 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.5 t -130.24 143.93 51.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.146 -175.199 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 34.7 t -103.31 146.24 28.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.386 0.612 . . . . 0.0 110.762 -178.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.492 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 2.7 mm? -128.32 166.96 17.63 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.161 -178.496 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.604 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -149.39 133.94 17.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.85 179.129 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -151.59 174.34 13.56 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -175.386 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.491 ' HD2' ' N ' ' A' ' 62' ' ' ARG . 8.4 mpt_? -104.88 167.1 9.93 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 120.891 0.376 . . . . 0.0 111.363 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -43.98 -56.71 3.77 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 115.08 -0.964 . . . . 0.0 112.902 177.8 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -56.0 -40.12 72.89 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.272 0.558 . . . . 0.0 111.149 -176.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -70.76 -31.23 67.96 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.166 -176.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.472 HD11 HD12 ' A' ' 71' ' ' LEU . 18.2 tp -68.26 -39.49 82.18 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.295 176.408 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.416 ' O ' ' HB2' ' A' ' 16' ' ' SER . . . -63.91 -14.11 50.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.859 -177.556 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 83.8 mt -80.33 -16.49 54.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.985 0.421 . . . . 0.0 110.68 177.054 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.655 HD11 HD13 ' A' ' 32' ' ' LEU . 80.2 mt -109.2 151.35 26.6 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.018 176.604 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 26.3 m -107.5 114.26 28.15 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.351 0.596 . . . . 0.0 109.996 172.106 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.511 ' CD2' HG12 ' A' ' 12' ' ' ILE . 58.7 mt -122.45 137.48 54.86 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.162 -0.927 . . . . 0.0 110.335 -175.277 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.435 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 27.6 m -127.91 137.04 29.95 Favored Pre-proline 0 C--N 1.322 -0.605 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 174.746 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.497 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 13.6 Cg_exo -68.32 163.15 37.47 Favored 'Trans proline' 0 N--CA 1.463 -0.319 0 C-N-CA 122.124 1.883 . . . . 0.0 111.911 -178.602 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.524 HD12 ' HB2' ' A' ' 9' ' ' SER . 78.8 mt -79.43 -37.02 38.04 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.359 0.6 . . . . 0.0 110.156 175.078 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 29.7 t70 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.269 -0.872 . . . . 0.0 109.882 177.879 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 36.6 t . . . . . 0 N--CA 1.452 -0.356 0 CA-C-O 120.697 0.284 . . . . 0.0 110.548 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.4 ' O ' HG12 ' A' ' 40' ' ' VAL . 53.5 mtp180 -135.44 161.49 35.32 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.046 0.451 . . . . 0.0 110.839 -176.121 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.535 ' HB2' HD12 ' A' ' 74' ' ' LEU . 19.8 m -118.51 141.83 48.19 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.796 179.011 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.528 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 4.6 m-85 -130.02 133.11 46.52 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.25 -174.758 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.603 ' HG2' ' HB2' ' A' ' 37' ' ' ALA . 55.7 mtt-85 -89.1 159.03 17.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.071 0.462 . . . . 0.0 110.751 177.092 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 40.0 mt -100.55 111.39 30.09 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.07 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.24 -27.21 53.24 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.458 0.647 . . . . 0.0 110.256 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.568 ' HA2' ' HB3' ' A' ' 34' ' ' PRO . . . 153.61 -149.83 21.4 Favored Glycine 0 N--CA 1.441 -0.975 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.481 -177.498 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.607 ' CE1' ' HG3' ' A' ' 24' ' ' ARG . 19.5 m-85 -118.11 151.62 37.2 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 -179.307 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.523 ' O ' HG22 ' A' ' 19' ' ' ILE . 25.2 m -64.4 143.05 98.48 Favored Pre-proline 0 N--CA 1.447 -0.581 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 178.369 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 26.0 Cg_exo -62.69 -0.42 1.97 Allowed 'Trans proline' 0 CA--C 1.532 0.424 0 C-N-CA 123.268 2.646 . . . . 0.0 113.901 -173.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.75 -6.59 39.38 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.755 0.312 . . . . 0.0 111.463 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.523 HG22 ' O ' ' A' ' 16' ' ' SER . 12.7 tt -88.01 148.51 4.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 120.974 0.416 . . . . 0.0 110.647 -177.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.511 ' HB3' ' HD2' ' A' ' 23' ' ' TYR . 13.2 t -89.33 162.81 15.62 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.957 179.358 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -69.71 -40.59 76.17 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 -173.853 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.39 -33.94 86.43 Favored Glycine 0 CA--C 1.517 0.214 0 C-N-CA 120.422 -0.894 . . . . 0.0 112.037 177.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.511 ' HD2' ' HB3' ' A' ' 20' ' ' SER . 41.1 m-85 -67.15 -38.75 86.05 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 120.782 0.325 . . . . 0.0 110.319 175.771 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.607 ' HG3' ' CE1' ' A' ' 15' ' ' TYR . 20.2 ttm180 -59.24 -43.34 92.38 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.899 175.235 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -64.42 -37.14 86.5 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.368 -178.528 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 62.2 ttt180 -72.38 -36.53 68.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.207 178.605 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.423 HD23 ' HE3' ' A' ' 30' ' ' MET . 73.8 mt -68.76 -43.37 75.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.411 179.038 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -58.78 -45.39 89.92 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.92 178.305 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 64.9 m -64.32 -31.6 72.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.588 179.37 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.423 ' HE3' HD23 ' A' ' 27' ' ' LEU . 71.7 mtm -81.33 -15.11 56.34 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.692 -179.576 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 116.96 6.92 13.43 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.406 -0.902 . . . . 0.0 113.611 174.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.4 mt -105.42 98.02 7.78 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 178.326 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.437 ' H ' HD23 ' A' ' 33' ' ' LEU . 1.9 pt? -128.95 150.76 76.14 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.258 -174.538 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.568 ' HB3' ' HA2' ' A' ' 14' ' ' GLY . 37.9 Cg_endo -66.23 135.01 38.46 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.807 2.338 . . . . 0.0 111.534 178.39 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 107.16 -19.73 34.3 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.332 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.32 -171.41 3.56 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-O 121.327 0.584 . . . . 0.0 110.57 -178.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.603 ' HB2' ' HG2' ' A' ' 11' ' ' ARG . . . -148.22 135.9 20.76 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.287 -177.13 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.495 HD13 HG21 ' A' ' 52' ' ' VAL . 51.0 mt -108.8 131.88 54.54 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.159 0.504 . . . . 0.0 110.523 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 6.4 ttp85 -101.94 123.43 45.85 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.321 -0.854 . . . . 0.0 108.831 175.568 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.608 ' HA ' HG12 ' A' ' 52' ' ' VAL . 10.8 p -69.13 127.2 30.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 121.405 0.622 . . . . 0.0 111.391 -175.308 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.5 t -88.44 -50.64 13.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.761 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.927 174.44 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 38.9 ttm180 -175.18 142.97 0.65 Allowed 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.192 0.52 . . . . 0.0 112.033 -178.624 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 98.0 mt -100.86 140.57 19.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 168.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.796 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -82.64 147.93 56.86 Favored Pre-proline 0 C--N 1.324 -0.528 0 O-C-N 122.247 -0.283 . . . . 0.0 111.087 -178.668 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -67.18 -2.05 7.37 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 123.25 2.633 . . . . 0.0 112.915 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.446 ' HA ' HD22 ' A' ' 46' ' ' LEU . 1.0 OUTLIER -56.57 -38.92 72.63 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 122.153 0.978 . . . . 0.0 109.448 174.921 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.55 ' O ' ' HB2' ' A' ' 48' ' ' ASP . . . 153.18 -55.0 0.44 Allowed Glycine 0 N--CA 1.434 -1.489 0 N-CA-C 108.289 -1.924 . . . . 0.0 108.289 -170.935 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.55 ' HB2' ' O ' ' A' ' 47' ' ' GLY . 13.0 t70 169.24 120.31 0.04 OUTLIER Pre-proline 0 N--CA 1.452 -0.373 0 O-C-N 125.155 1.15 . . . . 0.0 113.075 168.318 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.796 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 27.8 Cg_endo -109.94 163.53 0.07 OUTLIER 'Trans proline' 0 N--CA 1.433 -2.038 1 C-N-CA 125.307 4.005 . . . . 0.0 108.097 137.324 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.819 HG22 HG13 ' A' ' 52' ' ' VAL . 30.8 mt -115.87 103.97 16.02 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 C-N-CA 119.31 -0.956 . . . . 0.0 110.672 -177.678 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.462 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 97.9 mt-30 -84.63 113.17 21.08 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 173.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.819 HG13 HG22 ' A' ' 50' ' ' ILE . 15.5 m -132.98 165.68 31.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 120.887 0.375 . . . . 0.0 111.481 -177.384 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -147.26 141.04 25.72 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.523 -0.918 . . . . 0.0 108.523 176.048 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 8.9 t -95.89 -47.7 6.03 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.169 -0.612 . . . . 0.0 109.699 176.701 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 55' ' ' ARG . 13.9 ptt180 177.24 24.04 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.474 0.71 . . . . 0.0 109.554 175.105 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -127.32 -65.71 0.92 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.082 -172.083 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.3 t -164.47 153.73 13.47 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.052 -178.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.403 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 10.5 m -71.89 141.39 49.54 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.135 0.493 . . . . 0.0 111.139 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.462 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 65.8 tp -139.9 144.6 37.23 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.031 178.177 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.419 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -112.56 141.39 46.38 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.605 179.555 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.59 HD11 HD12 ' A' ' 50' ' ' ILE . 4.0 pp -142.29 161.43 38.05 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 -179.208 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.677 ' HD3' ' OD2' ' A' ' 65' ' ' ASP . 2.8 mpt_? -96.75 175.37 6.39 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.005 0.431 . . . . 0.0 109.979 -177.22 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.1 mmt180 -66.2 -33.52 75.95 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.508 177.163 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -66.87 -35.3 79.7 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.664 177.171 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.677 ' OD2' ' HD3' ' A' ' 62' ' ' ARG . 41.4 m-20 -68.23 -42.5 79.64 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-O 121.422 0.629 . . . . 0.0 109.366 175.111 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 45.5 tp -60.21 -32.37 71.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.875 178.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.84 -21.57 66.48 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.453 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 89.6 mt -86.03 -18.61 32.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.92 0.39 . . . . 0.0 110.996 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 88.7 mt -104.39 141.85 35.61 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.709 -177.94 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 20.2 m -101.29 115.67 31.03 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 172.334 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 73.2 mt -117.83 147.69 42.81 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.246 -176.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.424 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 4.6 m -128.26 115.33 20.02 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.645 172.287 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.528 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 21.9 Cg_exo -65.31 161.62 36.94 Favored 'Trans proline' 0 N--CA 1.464 -0.251 0 C-N-CA 122.134 1.889 . . . . 0.0 112.323 -177.837 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.535 HD12 ' HB2' ' A' ' 9' ' ' SER . 97.6 mt -93.56 -15.48 25.4 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 121.341 0.591 . . . . 0.0 109.705 176.413 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.4 t70 . . . . . 0 C--O 1.244 0.809 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.407 176.739 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.6 t . . . . . 0 N--CA 1.455 -0.181 0 CA-C-O 120.868 0.366 . . . . 0.0 111.079 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -103.71 173.21 6.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.621 0.724 . . . . 0.0 112.057 -172.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.446 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 13.4 t -137.92 140.42 40.3 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.66 172.916 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.404 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 19.3 m-85 -123.87 129.11 50.47 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.261 -175.424 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.421 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 36.3 mtt-85 -88.96 146.84 24.64 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 177.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.516 HG12 ' CD2' ' A' ' 71' ' ' LEU . 36.7 mt -90.91 111.59 23.88 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 175.429 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 18.5 m -79.08 -22.24 45.58 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.341 0.591 . . . . 0.0 110.336 178.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.655 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 156.94 -142.78 8.96 Favored Glycine 0 N--CA 1.443 -0.873 0 C-N-CA 120.834 -0.698 . . . . 0.0 111.785 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.577 ' HB3' HG21 ' A' ' 19' ' ' ILE . 34.0 m-85 -121.82 151.16 40.92 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.64 ' O ' HG22 ' A' ' 19' ' ' ILE . 74.3 p -69.59 159.16 84.89 Favored Pre-proline 0 N--CA 1.445 -0.68 0 CA-C-O 120.683 0.278 . . . . 0.0 111.002 -177.226 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_exo -73.44 11.57 0.99 Allowed 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 122.533 2.155 . . . . 0.0 111.961 174.529 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -103.77 -14.26 16.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.766 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.64 HG22 ' O ' ' A' ' 16' ' ' SER . 13.0 tt -89.43 142.96 12.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 120.77 0.319 . . . . 0.0 110.166 179.572 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.7 t -161.36 -174.69 4.41 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.624 0.25 . . . . 0.0 110.368 -174.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.1 t30 59.15 34.91 23.49 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.284 0.634 . . . . 0.0 111.793 174.061 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.39 6.0 87.84 Favored Glycine 0 CA--C 1.519 0.293 0 C-N-CA 120.838 -0.696 . . . . 0.0 114.011 174.707 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -62.22 -22.83 66.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 117.31 0.555 . . . . 0.0 110.889 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.494 ' HG2' ' CG ' ' A' ' 15' ' ' TYR . 34.6 mtt85 -63.95 -42.84 97.18 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.746 174.655 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -66.88 -35.79 80.83 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 121.231 0.539 . . . . 0.0 109.802 177.733 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 86.1 mtt180 -62.13 -44.14 97.28 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.814 176.302 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.612 HD22 HD12 ' A' ' 32' ' ' LEU . 38.2 mt -69.56 -41.71 75.5 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.493 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -58.14 -47.44 83.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.415 178.297 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 59.3 m -63.34 -28.68 70.17 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.571 -179.463 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.422 ' HE3' HD23 ' A' ' 27' ' ' LEU . 67.9 mtm -84.71 -12.99 52.68 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.424 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 114.76 -0.28 23.1 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.471 -0.871 . . . . 0.0 113.261 174.385 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.821 HD13 HD11 ' A' ' 69' ' ' LEU . 88.7 mt -96.05 100.44 12.1 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.968 0.413 . . . . 0.0 110.107 -178.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 pp -138.89 155.42 73.09 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.069 -175.395 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.655 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 23.0 Cg_exo -64.4 137.61 56.39 Favored 'Trans proline' 0 C--O 1.234 0.308 0 C-N-CA 122.9 2.4 . . . . 0.0 112.052 179.528 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 111.04 -28.12 10.14 Favored Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.313 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.03 154.08 21.04 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-O 121.122 0.486 . . . . 0.0 110.105 -179.041 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.421 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -129.94 138.17 50.74 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.973 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.65 ' HB3' ' HB ' ' A' ' 52' ' ' VAL . 2.2 mm? -106.87 142.19 36.9 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.268 179.803 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 35.5 ttt180 -94.16 132.85 38.28 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 173.318 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.591 ' HA ' HG12 ' A' ' 52' ' ' VAL . 7.6 p -71.64 128.28 34.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.157 0.504 . . . . 0.0 111.084 -175.597 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.0 t -99.35 -44.87 11.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.611 176.447 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 57.9 ttt180 -176.52 135.79 0.25 Allowed 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 -177.501 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.424 HG23 ' HD2' ' A' ' 49' ' ' PRO . 4.8 mp -116.6 128.76 73.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 166.0 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.428 ' H ' ' CD ' ' A' ' 49' ' ' PRO . . . -67.12 125.49 91.05 Favored Pre-proline 0 C--N 1.32 -0.675 0 C-N-CA 121.048 -0.261 . . . . 0.0 110.442 176.462 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -57.36 -14.45 15.98 Favored 'Trans proline' 0 N--CA 1.475 0.428 0 C-N-CA 123.426 2.751 . . . . 0.0 113.107 -179.098 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -54.92 -33.24 61.95 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.315 176.618 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 164.37 -75.64 0.16 Allowed Glycine 0 N--CA 1.435 -1.419 0 N-CA-C 110.981 -0.848 . . . . 0.0 110.981 -177.425 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -164.68 118.53 0.99 Allowed Pre-proline 0 N--CA 1.443 -0.818 0 N-CA-C 114.522 1.304 . . . . 0.0 114.522 179.364 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.428 ' CD ' ' H ' ' A' ' 44' ' ' ALA . 82.3 Cg_endo -118.61 -175.5 0.02 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.714 1 C-N-CA 126.994 5.129 . . . . 0.0 107.988 132.738 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.509 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 67.3 mt -145.11 104.43 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.237 0 C-N-CA 120.117 -0.633 . . . . 0.0 109.882 173.253 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.443 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 8.9 tt0 -92.96 120.64 33.49 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 174.233 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.65 ' HB ' ' HB3' ' A' ' 38' ' ' LEU . 7.6 m -140.53 162.02 23.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.777 0.322 . . . . 0.0 111.025 -176.841 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -119.12 135.61 54.57 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.024 -0.534 . . . . 0.0 109.689 -178.804 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.0 t -88.91 -33.12 17.4 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.704 -0.399 . . . . 0.0 110.044 179.336 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 35.1 ttm180 178.24 -61.25 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.308 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -107.31 -38.33 5.99 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.513 178.598 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.0 t -109.0 150.2 28.1 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.901 0.381 . . . . 0.0 110.845 -174.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.2 p -114.38 144.91 42.53 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.649 179.196 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.443 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 6.2 mp -127.45 162.01 27.38 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.987 -176.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.509 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -131.41 142.18 49.98 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.858 177.097 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.498 HD13 ' HB2' ' A' ' 65' ' ' ASP . 3.9 pp -153.82 177.34 11.11 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 -174.976 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.409 ' HD2' ' O ' ' A' ' 61' ' ' LEU . 15.1 mmm-85 -121.92 -175.04 3.02 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.931 0.872 . . . . 0.0 111.521 -178.673 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.0 ptp180 -56.04 -34.0 65.47 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 113.757 -1.565 . . . . 0.0 111.669 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -63.11 -44.61 95.15 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.478 179.297 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.498 ' HB2' HD13 ' A' ' 61' ' ' LEU . 7.7 m-20 -67.63 -39.45 84.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.246 0.546 . . . . 0.0 109.601 178.122 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 66.3 tp -60.03 -39.64 86.58 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.289 -0.868 . . . . 0.0 110.878 177.37 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.45 -12.84 61.61 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.231 -0.441 . . . . 0.0 112.118 -176.483 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.497 ' HB3' HD12 ' A' ' 19' ' ' ILE . 93.8 mt -93.32 -21.33 19.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.79 0.329 . . . . 0.0 110.81 179.459 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.821 HD11 HD13 ' A' ' 32' ' ' LEU . 96.9 mt -107.25 140.32 40.32 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.463 -175.102 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.5 m -91.27 112.29 24.14 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 169.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.516 ' CD2' HG12 ' A' ' 12' ' ' ILE . 82.6 mt -120.92 128.05 52.41 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.307 -174.485 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.417 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 34.9 m -124.93 133.03 24.45 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.119 176.797 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 72' ' ' VAL . 18.5 Cg_exo -65.04 163.29 29.2 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.087 1.858 . . . . 0.0 111.414 179.223 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 9' ' ' SER . 91.3 mt -53.81 -57.62 10.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.216 0.531 . . . . 0.0 109.714 173.562 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.6 t70 . . . . . 0 C--O 1.251 1.132 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.416 176.413 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.0 t . . . . . 0 N--CA 1.451 -0.414 0 CA-C-O 120.765 0.317 . . . . 0.0 111.597 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 47.8 ttt85 -111.12 144.57 40.05 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.56 -171.384 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.1 t -123.21 139.78 53.7 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.925 -178.815 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.648 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 8.3 m-85 -116.66 133.19 56.31 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -178.307 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.456 ' CZ ' HD23 ' A' ' 74' ' ' LEU . 11.2 ptp180 -102.73 157.91 16.62 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 175.654 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.493 HG12 ' CD2' ' A' ' 71' ' ' LEU . 19.6 mt -104.66 115.04 45.81 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.131 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.018 -178.381 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 1.5 p -93.05 -16.27 25.19 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.664 0.269 . . . . 0.0 111.255 178.77 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.541 ' HA2' ' HB3' ' A' ' 34' ' ' PRO . . . 165.13 -153.84 24.24 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.487 -0.863 . . . . 0.0 112.28 178.034 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.52 ' CE1' ' HD3' ' A' ' 34' ' ' PRO . 60.9 m-85 -119.86 153.32 36.0 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 -178.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.591 ' O ' HG22 ' A' ' 19' ' ' ILE . 29.2 m -67.89 138.47 92.85 Favored Pre-proline 0 N--CA 1.441 -0.875 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 176.931 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -65.98 6.82 0.42 Allowed 'Trans proline' 0 CA--C 1.532 0.415 0 C-N-CA 122.771 2.314 . . . . 0.0 113.481 -175.568 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -106.39 7.77 31.29 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.705 179.053 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.591 HG22 ' O ' ' A' ' 16' ' ' SER . 13.5 tt -96.97 132.87 40.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 CA-C-O 121.034 0.445 . . . . 0.0 110.464 177.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.9 t -156.75 -161.54 1.11 Allowed 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 -176.241 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 67.51 16.55 9.96 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.652 0.739 . . . . 0.0 110.924 175.583 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 79.69 4.05 89.23 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.51 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -66.11 -27.67 68.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.223 0.535 . . . . 0.0 110.245 -178.094 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 27.4 ttm180 -64.02 -41.95 97.27 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.023 176.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -69.69 -32.86 71.71 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.508 177.777 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -64.08 -43.33 95.75 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.997 0.427 . . . . 0.0 109.969 175.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.565 HD22 HD12 ' A' ' 32' ' ' LEU . 57.8 mt -64.3 -45.69 86.87 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.092 176.926 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -56.69 -45.33 81.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.417 178.146 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 48.8 m -63.19 -33.38 75.34 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.048 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 71.5 mtm -81.79 -10.44 59.34 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.434 -179.499 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 108.1 5.0 33.2 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.661 -0.78 . . . . 0.0 113.138 174.449 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.595 HD13 HD11 ' A' ' 69' ' ' LEU . 97.5 mt -94.0 91.0 6.66 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 177.906 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.8 pp -135.75 157.85 75.32 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.336 -174.721 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.541 ' HB3' ' HA2' ' A' ' 14' ' ' GLY . 32.3 Cg_endo -65.69 124.01 12.18 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.698 2.265 . . . . 0.0 111.627 177.903 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.56 -7.41 17.95 Favored Glycine 0 N--CA 1.444 -0.819 0 C-N-CA 120.818 -0.706 . . . . 0.0 111.843 -176.317 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -97.27 -172.52 2.44 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-O 120.985 0.422 . . . . 0.0 110.553 178.189 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.452 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -160.13 149.71 17.86 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.654 -176.464 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 58.8 mt -125.22 138.53 54.12 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.781 178.714 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 36.9 ttp180 -111.5 124.22 51.84 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 176.396 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.555 ' HA ' HG12 ' A' ' 52' ' ' VAL . 7.4 p -61.58 127.79 21.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-O 121.109 0.481 . . . . 0.0 112.11 -174.458 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 92.7 t -102.71 -50.9 9.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.917 171.306 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.402 ' HG3' ' HB2' ' A' ' 51' ' ' GLN . 5.9 ptm180 -170.67 161.05 7.37 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.122 0.487 . . . . 0.0 111.785 -178.696 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 82.5 mt -135.1 143.19 37.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 171.623 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.761 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -69.13 142.34 92.78 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 117.88 0.309 . . . . 0.0 110.841 179.065 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 22.7 Cg_exo -66.06 -8.92 21.52 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 123.184 2.589 . . . . 0.0 113.25 -177.702 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.419 HD13 ' HA ' ' A' ' 46' ' ' LEU . 4.0 mm? -65.86 -88.48 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.643 0.735 . . . . 0.0 110.443 176.644 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -123.95 -74.53 0.27 Allowed Glycine 0 CA--C 1.491 -1.444 0 N-CA-C 109.425 -1.47 . . . . 0.0 109.425 172.479 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.442 ' OD2' ' HB3' ' A' ' 63' ' ' ARG . 4.9 p-10 -178.44 124.41 0.26 Allowed Pre-proline 0 N--CA 1.44 -0.955 0 N-CA-C 113.995 1.109 . . . . 0.0 113.995 174.398 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.761 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 15.1 Cg_endo -105.45 157.82 0.16 Allowed 'Trans proline' 0 N--CA 1.437 -1.812 0 C-N-CA 125.005 3.803 . . . . 0.0 107.458 136.539 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.625 HG22 HG13 ' A' ' 52' ' ' VAL . 4.5 mp -119.8 104.88 16.29 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.706 0 C-N-CA 118.988 -1.085 . . . . 0.0 110.365 -175.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.434 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 26.1 mp0 -88.65 117.85 27.9 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.078 174.915 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.625 HG13 HG22 ' A' ' 50' ' ' ILE . 14.1 m -132.94 172.44 16.46 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.51 -178.726 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.572 ' HG2' ' H ' ' A' ' 55' ' ' ARG . 34.0 tt0 -117.58 130.83 56.64 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.004 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 17.8 p -92.53 17.89 9.41 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.088 -179.209 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.572 ' H ' ' HG2' ' A' ' 53' ' ' GLU . 0.0 OUTLIER 63.32 21.09 12.63 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.818 0.818 . . . . 0.0 109.005 -173.935 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -141.72 -62.37 0.46 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.993 -1.003 . . . . 0.0 108.512 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.7 t -142.92 174.72 10.42 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.679 178.415 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 17.8 m -82.49 143.45 31.11 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.99 0.424 . . . . 0.0 110.331 178.672 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.434 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 43.8 tp -134.14 144.62 48.65 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.572 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.539 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -133.07 139.72 47.3 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.74 -0.663 . . . . 0.0 109.574 177.604 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.0 pp -154.84 178.81 9.73 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -176.313 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 25.6 mmt85 -115.73 170.55 8.37 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 121.92 0.866 . . . . 0.0 112.206 -178.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.442 ' HB3' ' OD2' ' A' ' 48' ' ' ASP . 13.1 ptt-85 -62.14 -36.15 80.91 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 113.611 -1.631 . . . . 0.0 111.766 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.428 ' HE3' ' HB3' ' A' ' 64' ' ' LYS . 1.3 tmmt? -58.16 -45.85 86.74 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.923 0.392 . . . . 0.0 110.624 178.969 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -71.74 -37.75 70.52 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.324 0.583 . . . . 0.0 110.137 178.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 18.7 tp -64.12 -33.25 75.34 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.78 -179.052 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.27 -18.37 63.13 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.777 -178.376 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.438 ' HB3' HD12 ' A' ' 19' ' ' ILE . 91.2 mt -88.76 -7.49 56.14 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.757 0.313 . . . . 0.0 110.959 -179.701 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.595 HD11 HD13 ' A' ' 32' ' ' LEU . 94.7 mt -103.49 141.75 35.46 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.545 178.929 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 25.1 m -96.77 114.52 26.16 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 172.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.493 ' CD2' HG12 ' A' ' 12' ' ' ILE . 74.5 mt -121.79 134.98 54.91 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.047 -172.53 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.446 ' O ' ' HG2' ' A' ' 11' ' ' ARG . 17.1 m -127.61 128.48 23.94 Favored Pre-proline 0 C--N 1.319 -0.725 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 170.573 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.648 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 36.9 Cg_endo -65.63 163.4 30.36 Favored 'Trans proline' 0 C--O 1.234 0.29 0 C-N-CA 122.526 2.151 . . . . 0.0 113.545 -173.231 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.456 HD23 ' CZ ' ' A' ' 11' ' ' ARG . 95.7 mt -94.63 -71.77 0.65 Allowed 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.292 -0.867 . . . . 0.0 108.708 173.125 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 . . . . . 0 C--O 1.253 1.249 0 CA-C-O 117.748 -1.12 . . . . 0.0 109.304 175.603 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 23.4 t . . . . . 0 N--CA 1.448 -0.532 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.407 ' H ' HG12 ' A' ' 40' ' ' VAL . 88.3 mtt180 -149.34 153.47 37.5 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 120.857 0.36 . . . . 0.0 110.775 177.02 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.514 ' HB2' HD12 ' A' ' 74' ' ' LEU . 2.2 m -95.79 135.56 37.35 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.921 179.414 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.542 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 44.8 m-85 -113.97 141.09 47.83 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.213 -177.712 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.53 ' HD2' HD23 ' A' ' 74' ' ' LEU . 45.4 mtp180 -97.96 144.94 26.98 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 178.652 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.439 HG12 ' CD2' ' A' ' 71' ' ' LEU . 18.7 mt -99.02 113.67 34.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 177.235 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 12.6 p -102.0 -3.63 27.4 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -175.481 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.491 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 160.46 -161.73 32.84 Favored Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 119.946 -1.121 . . . . 0.0 112.445 175.541 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -118.93 156.61 29.25 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 36.9 t -66.1 137.36 95.74 Favored Pre-proline 0 C--N 1.319 -0.726 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 170.496 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -59.22 -14.81 25.77 Favored 'Trans proline' 0 CA--C 1.529 0.272 0 C-N-CA 122.838 2.359 . . . . 0.0 112.867 -176.5 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -78.3 -8.59 58.57 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.746 -178.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 15.7 tt -63.16 129.12 26.29 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-O 121.163 0.506 . . . . 0.0 110.523 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.3 t -134.21 178.16 7.19 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.318 -172.031 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 58.58 -158.99 0.29 Allowed 'General case' 0 CA--C 1.534 0.352 0 O-C-N 123.651 0.594 . . . . 0.0 109.59 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -94.09 25.62 21.11 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.817 -0.706 . . . . 0.0 111.782 176.883 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.447 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 4.9 t80 -64.48 -32.3 73.87 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.024 0.44 . . . . 0.0 110.154 -177.483 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 14.4 ttm180 -58.9 -42.11 88.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.464 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -65.61 -39.73 91.85 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.409 -179.597 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 34.1 ttt180 -66.17 -39.49 89.79 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.972 178.115 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 23' ' ' TYR . 85.2 mt -66.83 -44.3 81.44 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.349 179.298 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -57.62 -44.75 85.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.115 177.349 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 47.2 m -63.21 -34.17 77.06 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.172 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.525 ' HA ' ' CE ' ' A' ' 30' ' ' MET . 15.9 mmt -74.34 -24.67 59.22 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.848 -179.667 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.06 6.04 14.35 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.498 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.677 HD13 HD11 ' A' ' 69' ' ' LEU . 68.7 mt -97.66 90.86 5.15 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.2 pp -141.29 155.15 67.95 Favored Pre-proline 0 C--N 1.322 -0.604 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.065 -174.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.491 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 24.0 Cg_exo -63.72 127.05 18.71 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.815 2.343 . . . . 0.0 111.931 178.957 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.64 5.67 44.86 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.081 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -107.52 -179.45 3.92 Favored 'General case' 0 N--CA 1.442 -0.853 0 CA-C-O 120.968 0.413 . . . . 0.0 109.957 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -148.55 145.59 27.92 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.093 -177.846 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.471 HD13 HG21 ' A' ' 52' ' ' VAL . 45.6 mt -129.39 131.12 46.74 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.45 177.924 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.476 ' HA ' ' HA ' ' A' ' 9' ' ' SER . 38.3 ttm180 -100.61 118.84 37.58 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.222 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.634 ' HA ' HG12 ' A' ' 52' ' ' VAL . 7.5 p -65.32 131.09 31.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.56 0.695 . . . . 0.0 111.506 -174.808 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.754 HG12 ' HG3' ' A' ' 42' ' ' ARG . 59.2 t -95.84 -54.97 6.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.942 174.111 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.754 ' HG3' HG12 ' A' ' 41' ' ' VAL . 54.9 mtp180 -155.23 143.49 20.24 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -176.168 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.432 HG23 ' HD2' ' A' ' 49' ' ' PRO . 4.7 mp -114.87 119.43 61.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 161.961 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.417 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -56.91 127.87 75.77 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-O 120.525 0.202 . . . . 0.0 111.129 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 38.4 Cg_exo -62.33 -8.56 12.83 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 123.415 2.743 . . . . 0.0 112.61 -179.18 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -56.24 -38.36 70.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.554 173.589 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 170.52 -77.01 0.1 OUTLIER Glycine 0 N--CA 1.438 -1.172 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 -176.433 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -169.85 120.74 0.58 Allowed Pre-proline 0 N--CA 1.452 -0.361 0 CA-C-O 122.257 1.027 . . . . 0.0 113.666 177.466 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.432 ' HD2' HG23 ' A' ' 43' ' ' ILE . 89.7 Cg_endo -117.96 -166.79 0.01 OUTLIER 'Trans proline' 0 N--CA 1.438 -1.786 1 C-N-CA 126.337 4.691 . . . . 0.0 107.777 139.206 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.741 HG22 HG13 ' A' ' 52' ' ' VAL . 54.5 mt -143.8 101.9 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.239 0 C-N-CA 120.255 -0.578 . . . . 0.0 109.628 168.124 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.514 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 54.2 mt-30 -87.91 119.09 27.93 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 175.876 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.741 HG13 HG22 ' A' ' 50' ' ' ILE . 17.7 m -132.68 171.88 17.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 120.802 0.335 . . . . 0.0 111.56 -175.379 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.498 ' HG3' ' H ' ' A' ' 55' ' ' ARG . 10.1 tp10 -138.82 141.19 38.71 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 176.201 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.1 t -124.13 18.53 9.16 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.639 0.733 . . . . 0.0 109.644 -176.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.498 ' H ' ' HG3' ' A' ' 53' ' ' GLU . 74.6 mtm180 74.52 23.7 1.87 Allowed 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.66 178.883 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -140.91 -52.92 0.47 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.275 0.56 . . . . 0.0 110.062 -178.402 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 59.9 m -153.84 135.67 14.54 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.472 -0.785 . . . . 0.0 109.428 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.5 m -76.65 131.52 38.89 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 175.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.514 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 3.0 mm? -121.64 171.75 8.61 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.98 0.419 . . . . 0.0 111.495 -176.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.539 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -146.25 141.79 27.72 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 174.172 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.458 ' C ' ' HD2' ' A' ' 62' ' ' ARG . 4.1 pp -146.18 155.45 42.72 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 120.693 -0.403 . . . . 0.0 110.167 -173.808 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.603 ' HD2' ' N ' ' A' ' 62' ' ' ARG . 4.2 mpt_? -104.39 164.79 11.49 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.585 -178.085 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.403 ' HA ' ' HB3' ' A' ' 66' ' ' LEU . 45.5 mtm180 -50.76 -36.05 34.8 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 114.858 -1.065 . . . . 0.0 112.925 -178.553 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -59.19 -49.33 78.26 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.761 0.315 . . . . 0.0 110.824 178.33 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -72.39 -34.37 67.88 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.035 0.445 . . . . 0.0 110.194 178.891 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.408 HD13 HD12 ' A' ' 50' ' ' ILE . 62.6 tp -62.71 -37.05 84.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.005 178.213 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.71 -18.56 65.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.731 -178.032 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 96.0 mt -94.77 -4.59 47.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.566 -178.02 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.677 HD11 HD13 ' A' ' 32' ' ' LEU . 92.1 mt -111.5 129.24 56.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.778 0.323 . . . . 0.0 111.521 -176.77 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.9 m -88.55 115.95 26.44 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 172.051 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.439 ' CD2' HG12 ' A' ' 12' ' ' ILE . 70.5 mt -124.93 135.33 52.74 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.021 -174.489 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 24.1 m -133.76 132.64 21.7 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.455 173.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.542 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 17.1 Cg_exo -66.07 164.05 29.06 Favored 'Trans proline' 0 CA--C 1.533 0.427 0 C-N-CA 122.48 2.12 . . . . 0.0 113.196 -175.398 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.53 HD23 ' HD2' ' A' ' 11' ' ' ARG . 39.2 mt -67.69 -26.32 66.12 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.207 175.631 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 37.1 t70 . . . . . 0 C--O 1.248 1.001 0 O-C-N 124.102 0.876 . . . . 0.0 110.707 -178.186 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.2 t . . . . . 0 N--CA 1.454 -0.244 0 CA-C-O 120.519 0.199 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -95.93 169.95 9.63 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.441 0.639 . . . . 0.0 111.78 -175.578 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.573 ' HB3' HD12 ' A' ' 74' ' ' LEU . 23.4 t -140.29 140.28 35.66 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 114.994 -1.003 . . . . 0.0 109.483 176.753 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.585 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 15.0 m-85 -121.14 128.33 52.43 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 -178.17 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.467 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 67.6 mtp180 -97.81 149.87 21.88 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.515 178.49 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 25.5 mt -88.08 117.2 31.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.545 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 8.8 t -94.8 -18.47 21.2 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.944 0.402 . . . . 0.0 110.271 -179.692 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 166.89 -161.66 35.46 Favored Glycine 0 N--CA 1.443 -0.849 0 C-N-CA 120.449 -0.881 . . . . 0.0 112.269 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -105.81 158.35 16.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.677 0.275 . . . . 0.0 110.446 -178.253 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.459 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 31.3 t -52.05 134.24 39.69 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.945 175.739 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 17.7 Cg_exo -67.77 2.53 2.44 Favored 'Trans proline' 0 C--O 1.235 0.374 0 C-N-CA 122.954 2.436 . . . . 0.0 112.649 178.5 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -115.52 6.7 14.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.916 178.631 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.457 HG22 ' O ' ' A' ' 16' ' ' SER . 10.8 tt -87.9 150.48 3.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.908 0.385 . . . . 0.0 110.812 -177.831 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 35.4 t -89.67 158.69 17.47 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.156 178.113 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.459 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 88.1 m-20 -54.95 -44.3 74.2 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.237 -179.237 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.1 -36.67 92.22 Favored Glycine 0 C--N 1.329 0.173 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.833 -176.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -72.71 -31.19 64.82 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.435 ' HB3' ' O ' ' A' ' 21' ' ' ASN . 12.8 ttt180 -62.0 -43.79 98.1 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.746 172.598 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.459 ' HG3' ' O ' ' A' ' 21' ' ' ASN . 77.5 mt-30 -61.1 -41.88 97.48 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.565 177.182 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -57.83 -48.53 79.51 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.326 175.599 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.53 HD22 HD12 ' A' ' 32' ' ' LEU . 41.2 mt -67.55 -40.15 84.99 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.682 -176.677 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -60.34 -46.14 90.95 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.026 178.445 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 46.1 m -65.99 -31.49 72.42 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.141 179.367 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 82.5 mtp -71.03 -24.52 62.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.536 177.456 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 112.39 6.54 23.62 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.89 -0.671 . . . . 0.0 112.184 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.573 HD13 HD11 ' A' ' 69' ' ' LEU . 85.8 mt -98.31 97.3 8.69 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.989 0.423 . . . . 0.0 110.051 -178.272 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.4 pp -142.06 157.6 63.5 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.871 -176.912 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.66 139.38 88.59 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.731 2.287 . . . . 0.0 112.357 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 112.07 -21.07 20.87 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.328 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -85.53 -177.51 6.45 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 121.048 0.452 . . . . 0.0 110.35 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.467 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -159.65 134.93 8.22 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.91 -176.369 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.462 ' N ' HD22 ' A' ' 38' ' ' LEU . 2.2 mm? -108.55 141.18 40.85 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.622 176.486 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 20.5 ttm180 -109.09 127.72 54.38 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 176.656 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.572 ' HA ' HG12 ' A' ' 52' ' ' VAL . 9.9 p -67.27 127.71 29.29 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-O 121.309 0.576 . . . . 0.0 111.662 -172.6 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.8 t -106.73 -50.68 7.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.703 173.574 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.422 ' HE ' ' HB3' ' A' ' 42' ' ' ARG . 1.1 mtp180 -156.92 159.66 38.34 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -174.346 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.419 HG23 ' HD2' ' A' ' 49' ' ' PRO . 80.0 mt -127.45 142.53 43.33 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 162.397 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.646 ' H ' ' CD ' ' A' ' 49' ' ' PRO . . . -84.14 140.27 39.65 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-O 120.554 0.216 . . . . 0.0 111.523 -177.864 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -65.8 -7.39 16.5 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 123.107 2.538 . . . . 0.0 112.152 176.765 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.598 HD13 ' HB1' ' A' ' 44' ' ' ALA . 10.0 mp -57.76 -28.82 64.29 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.752 0.787 . . . . 0.0 110.336 173.36 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 153.95 -76.97 0.21 Allowed Glycine 0 N--CA 1.432 -1.633 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 -175.544 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -170.92 124.2 0.59 Allowed Pre-proline 0 N--CA 1.435 -1.195 0 CA-C-O 122.321 1.057 . . . . 0.0 113.094 174.331 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.646 ' CD ' ' H ' ' A' ' 44' ' ' ALA . 97.9 Cg_endo -115.04 -162.16 0.02 OUTLIER 'Trans proline' 0 N--CA 1.432 -2.146 1 C-N-CA 125.749 4.299 . . . . 0.0 107.686 143.3 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.791 HG22 HG13 ' A' ' 52' ' ' VAL . 52.5 mt -141.83 102.63 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.282 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 166.855 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -79.23 118.73 21.43 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 177.527 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.791 HG13 HG22 ' A' ' 50' ' ' ILE . 17.3 m -136.87 173.7 13.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-O 120.808 0.337 . . . . 0.0 111.313 -176.184 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -124.66 142.99 50.98 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 176.77 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 8.6 m -110.31 -39.25 5.02 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.683 -177.776 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 16.0 ptt180 179.46 -45.38 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.099 -0.5 . . . . 0.0 112.031 -177.189 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -132.27 -14.1 3.01 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -171.276 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.8 t -156.19 129.95 8.43 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.078 0.466 . . . . 0.0 110.279 -175.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.8 m -76.68 138.14 39.83 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.64 -177.356 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 16.6 mt -126.89 174.56 8.72 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.222 -175.49 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.457 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -134.78 161.24 35.73 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.35 178.392 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.786 HD11 HD12 ' A' ' 50' ' ' ILE . 4.2 pp -151.43 158.68 44.0 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 179.127 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.648 ' HD2' ' N ' ' A' ' 62' ' ' ARG . 6.3 mpt_? -109.32 176.35 5.12 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 -175.639 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -61.73 -38.27 87.28 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.032 178.359 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.449 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 55.0 tptt -64.53 -49.3 71.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.278 176.322 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -61.88 -39.33 91.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.587 179.657 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 55.6 tp -63.33 -37.82 88.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.817 178.148 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.66 -10.9 60.48 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.557 -178.213 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 64' ' ' LYS . 77.3 mt -87.07 -23.41 24.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.739 0.304 . . . . 0.0 111.05 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.573 HD11 HD13 ' A' ' 32' ' ' LEU . 95.7 mt -113.97 135.38 54.06 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.584 -178.64 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.9 m -90.4 115.85 27.89 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 174.206 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 80.2 mt -110.85 133.48 53.33 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.951 -175.385 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.3 m -114.55 114.87 44.71 Favored Pre-proline 0 C--N 1.319 -0.728 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.369 172.439 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.585 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 39.6 Cg_endo -68.31 163.0 38.05 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 121.988 1.792 . . . . 0.0 112.087 -177.938 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.573 HD12 ' HB3' ' A' ' 9' ' ' SER . 80.0 mt -76.28 1.76 15.17 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.412 175.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 32.5 t70 . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.408 -0.806 . . . . 0.0 109.808 178.131 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 18.9 t . . . . . 0 N--CA 1.447 -0.603 0 CA-C-O 120.454 0.169 . . . . 0.0 110.58 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.408 ' O ' HG12 ' A' ' 40' ' ' VAL . 86.8 mtt-85 -143.99 -174.91 4.4 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 121.108 0.48 . . . . 0.0 111.178 -172.87 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.466 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 17.8 m -101.44 144.97 29.58 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.083 -178.194 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.766 ' HE2' ' HB ' ' A' ' 40' ' ' VAL . 39.1 m-85 -121.61 128.13 51.61 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 177.307 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.493 ' HG2' ' HB2' ' A' ' 37' ' ' ALA . 98.3 mtt180 -90.25 155.81 18.74 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.569 -0.452 . . . . 0.0 110.584 178.349 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.7 mt -105.77 111.47 35.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.829 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 3.0 p -81.14 -21.3 39.91 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.896 0.379 . . . . 0.0 110.822 179.311 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.54 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 159.51 -144.49 10.23 Favored Glycine 0 N--CA 1.439 -1.11 0 C-N-CA 120.109 -1.044 . . . . 0.0 112.134 177.331 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.474 ' CB ' HG21 ' A' ' 19' ' ' ILE . 21.3 m-85 -123.96 157.82 33.47 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -177.659 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.487 ' O ' HG22 ' A' ' 19' ' ' ILE . 20.4 m -59.49 134.98 88.86 Favored Pre-proline 0 N--CA 1.447 -0.592 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 172.202 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 85.6 Cg_exo -48.05 -29.78 12.87 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 123.723 2.949 . . . . 0.0 114.736 -173.149 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -88.18 10.51 19.18 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -174.569 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.487 HG22 ' O ' ' A' ' 16' ' ' SER . 17.2 tt -77.71 114.74 18.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.492 0.663 . . . . 0.0 109.991 176.544 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.53 ' O ' ' HB2' ' A' ' 21' ' ' ASN . 65.4 m -165.83 99.17 0.66 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.825 -172.599 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.53 ' HB2' ' O ' ' A' ' 20' ' ' SER . 3.7 t30 171.37 33.27 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 177.64 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 73.47 -1.15 45.2 Favored Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.149 -173.08 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -60.55 -32.26 71.34 Favored 'General case' 0 C--N 1.334 -0.075 0 CA-C-O 120.774 0.321 . . . . 0.0 111.066 -175.578 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 11.8 mtp180 -62.27 -41.87 98.84 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.723 176.294 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -67.76 -34.69 77.31 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 120.963 0.411 . . . . 0.0 110.301 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.462 ' HA ' ' HD2' ' A' ' 26' ' ' ARG . 16.5 tpt180 -64.26 -42.91 96.25 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.771 -0.65 . . . . 0.0 109.978 176.028 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.637 HD13 HD21 ' A' ' 69' ' ' LEU . 90.6 mt -70.36 -38.08 74.71 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.504 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -59.53 -40.51 87.41 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.792 175.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 50.3 m -67.85 -33.23 74.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.838 179.336 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.544 ' HA ' ' CE ' ' A' ' 30' ' ' MET . 10.6 mmt -73.7 -23.17 59.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.868 178.39 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 109.28 12.67 19.29 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.894 -0.669 . . . . 0.0 112.343 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.4 mt -101.32 95.51 6.56 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.888 0.375 . . . . 0.0 110.325 -179.111 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.405 ' H ' HD23 ' A' ' 33' ' ' LEU . 1.9 pt? -130.88 154.74 82.02 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.288 -177.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.54 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 27.9 Cg_exo -61.48 119.49 6.66 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.722 2.281 . . . . 0.0 111.713 178.041 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.75 -7.12 17.68 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.773 -0.727 . . . . 0.0 111.996 -177.351 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -94.33 -171.96 2.66 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 120.984 0.421 . . . . 0.0 110.192 178.669 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.493 ' HB2' ' HG2' ' A' ' 11' ' ' ARG . . . -155.22 148.13 24.51 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.714 -177.014 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.571 HD13 HG21 ' A' ' 52' ' ' VAL . 33.0 mt -125.52 132.63 52.58 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 178.595 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 42.9 ttp180 -98.27 124.23 42.78 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 178.522 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.766 ' HB ' ' HE2' ' A' ' 10' ' ' TYR . 8.1 p -69.1 126.09 28.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.344 0.592 . . . . 0.0 111.416 -174.927 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 65.2 t -97.44 -44.58 12.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.353 177.141 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 78.8 ttt180 -165.41 135.55 3.64 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.868 0.366 . . . . 0.0 111.551 176.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.7 mp -90.77 129.33 41.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 172.699 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.436 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -64.62 131.45 95.12 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-O 120.656 0.265 . . . . 0.0 110.385 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 44.5 Cg_exo -58.31 -18.6 38.77 Favored 'Trans proline' 0 CA--C 1.532 0.404 0 C-N-CA 123.236 2.624 . . . . 0.0 113.093 -177.258 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -88.42 -20.46 25.22 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.334 -177.565 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 101.29 -13.56 58.48 Favored Glycine 0 C--O 1.235 0.177 0 N-CA-C 111.212 -0.755 . . . . 0.0 111.212 -173.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.583 ' CB ' ' HD2' ' A' ' 49' ' ' PRO . 0.5 OUTLIER -62.72 169.21 3.48 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 114.986 -0.607 . . . . 0.0 110.522 172.706 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.583 ' HD2' ' CB ' ' A' ' 48' ' ' ASP . 12.0 Cg_exo -29.07 151.68 0.01 OUTLIER 'Trans proline' 0 C--N 1.361 1.217 1 C-N-CA 125.335 4.024 . . . . 0.0 116.059 -170.786 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.504 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 60.0 mt -110.83 133.72 55.41 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 113.87 -1.514 . . . . 0.0 109.734 -173.08 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 -84.83 118.87 24.74 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.304 -179.261 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.571 HG21 HD13 ' A' ' 38' ' ' LEU . 27.6 m -128.92 167.12 24.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.1 178.337 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -129.29 151.0 50.42 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 -177.748 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 18.4 p -119.46 -64.28 1.29 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.627 -179.139 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.426 HH11 ' HD3' ' A' ' 55' ' ' ARG . 38.7 ttp180 -168.62 18.45 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.57 -176.677 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -148.29 -51.28 0.17 Allowed 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -172.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.4 t -173.02 167.2 5.01 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 -175.199 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.424 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 1.8 p -81.76 126.35 31.72 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.293 0.568 . . . . 0.0 111.417 -176.425 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 53.0 tp -118.87 147.22 44.2 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.79 -178.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.566 ' HB1' ' HB2' ' A' ' 49' ' ' PRO . . . -110.93 127.14 55.38 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.752 0.311 . . . . 0.0 110.602 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.7 pp -103.59 132.78 49.55 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.709 ' HD3' ' OD2' ' A' ' 65' ' ' ASP . 0.5 OUTLIER -75.49 174.45 9.63 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.069 0.461 . . . . 0.0 111.136 -170.715 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 23.0 mmm180 -62.19 -33.55 74.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.177 174.23 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -62.14 -52.75 62.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.841 177.39 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.709 ' OD2' ' HD3' ' A' ' 62' ' ' ARG . 33.4 m-20 -63.01 -41.99 99.7 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.087 -179.198 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 54.1 tp -60.18 -38.49 83.39 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.799 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.31 -15.76 62.42 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.953 0.406 . . . . 0.0 111.404 -179.121 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 94.4 mt -108.25 -4.32 17.65 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.383 -179.353 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.637 HD21 HD13 ' A' ' 27' ' ' LEU . 82.7 mt -110.67 134.82 52.11 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.778 0.323 . . . . 0.0 110.95 -179.355 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 32.2 m -106.58 116.9 32.73 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.213 0.53 . . . . 0.0 110.287 174.879 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.8 mp -124.62 150.49 45.96 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.696 -177.266 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 16.9 m -130.33 123.21 20.42 Favored Pre-proline 0 C--N 1.319 -0.731 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 175.052 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.46 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 36.2 Cg_endo -66.48 164.15 29.74 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.031 1.821 . . . . 0.0 111.601 179.032 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 9' ' ' SER . 91.1 mt -54.59 -40.88 69.27 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.796 172.35 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 22.8 t70 . . . . . 0 C--O 1.248 0.984 0 O-C-N 124.065 0.853 . . . . 0.0 110.843 173.864 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.42 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 22.7 t . . . . . 0 N--CA 1.453 -0.316 0 N-CA-C 110.159 -0.312 . . . . 0.0 110.159 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 53.2 mtt180 -129.52 -176.29 3.85 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 121.033 0.444 . . . . 0.0 110.733 -179.055 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.425 ' HB2' HD12 ' A' ' 74' ' ' LEU . 16.1 m -124.11 138.77 54.39 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.58 -178.565 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.439 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 52.3 m-85 -122.24 133.05 54.71 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.617 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.584 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 8.0 ptp180 -100.5 157.62 16.51 Favored 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 119.998 -0.681 . . . . 0.0 110.261 175.551 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.433 HG12 ' CD2' ' A' ' 71' ' ' LEU . 22.2 mt -100.64 116.35 43.94 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.944 -179.784 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 1.4 m -92.22 -19.75 21.89 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.882 -177.53 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 164.79 -149.41 16.12 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.424 -179.28 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.459 ' HB3' HG21 ' A' ' 19' ' ' ILE . 72.5 m-85 -121.97 152.63 39.5 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.828 0.347 . . . . 0.0 110.821 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.737 ' O ' HG22 ' A' ' 19' ' ' ILE . 49.4 m -82.24 153.25 68.85 Favored Pre-proline 0 N--CA 1.448 -0.542 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.887 -179.53 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -62.38 -16.26 50.48 Favored 'Trans proline' 0 CA--C 1.532 0.395 0 C-N-CA 122.693 2.262 . . . . 0.0 113.218 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -83.92 -7.18 59.49 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -177.58 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.737 HG22 ' O ' ' A' ' 16' ' ' SER . 10.4 tt -92.88 147.7 5.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 C-N-CA 120.556 -0.458 . . . . 0.0 110.719 -179.409 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.3 t -84.98 158.1 20.6 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.635 -0.505 . . . . 0.0 109.635 178.509 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.493 ' O ' ' HB3' ' A' ' 24' ' ' ARG . 26.8 t-20 -63.5 -47.48 81.54 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.649 0.261 . . . . 0.0 111.373 -174.993 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.73 -38.33 95.48 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.433 -0.889 . . . . 0.0 112.208 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -64.53 -39.89 94.6 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 177.742 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.493 ' HB3' ' O ' ' A' ' 21' ' ' ASN . 15.9 ttm180 -56.2 -45.22 79.92 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.376 172.76 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -68.91 -31.57 70.58 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.224 -178.889 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.466 ' O ' ' HG3' ' A' ' 30' ' ' MET . 4.0 tmm_? -68.71 -39.68 80.32 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 175.509 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.452 HD22 HD12 ' A' ' 32' ' ' LEU . 40.2 mt -68.18 -40.5 82.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.332 0.587 . . . . 0.0 110.317 176.786 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -55.57 -48.02 75.47 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.079 174.255 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 47.8 m -60.07 -33.89 72.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.15 178.686 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.466 ' HG3' ' O ' ' A' ' 26' ' ' ARG . 90.1 mtp -70.47 -27.33 64.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.898 178.649 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.77 8.07 11.22 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.356 -178.585 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.472 HD13 HD11 ' A' ' 69' ' ' LEU . 76.4 mt -99.69 94.03 6.14 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.009 0.433 . . . . 0.0 110.09 -179.388 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.515 ' HB2' ' HD2' ' A' ' 34' ' ' PRO . 1.7 pt? -140.31 161.83 53.03 Favored Pre-proline 0 N--CA 1.447 -0.596 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.496 -178.588 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.515 ' HD2' ' HB2' ' A' ' 33' ' ' LEU . 18.7 Cg_endo -59.74 128.46 27.01 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.867 2.378 . . . . 0.0 111.77 175.774 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 111.62 4.05 26.76 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.128 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -113.82 172.83 6.75 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 120.982 0.42 . . . . 0.0 110.132 178.201 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.584 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -152.89 139.66 18.95 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.412 -178.05 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.668 HD13 HG21 ' A' ' 52' ' ' VAL . 50.5 mt -127.16 136.72 52.47 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.193 -178.113 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 16.3 ttm180 -99.67 131.06 45.9 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 174.028 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.597 HG21 HD11 ' A' ' 43' ' ' ILE . 9.0 p -72.55 135.08 28.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.342 0.591 . . . . 0.0 111.695 -172.954 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 75.4 t -106.54 -47.34 8.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.643 176.331 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.626 ' HB2' ' HB2' ' A' ' 51' ' ' GLN . 79.0 mtt180 -157.64 138.91 13.57 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -172.533 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.597 HD11 HG21 ' A' ' 40' ' ' VAL . 4.5 mp -130.0 119.87 48.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 163.39 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.718 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -67.62 138.19 93.41 Favored Pre-proline 0 C--N 1.322 -0.607 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.125 -176.918 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -58.88 -19.17 45.99 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 123.618 2.879 . . . . 0.0 112.924 -178.463 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -55.96 -39.62 72.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.723 0.773 . . . . 0.0 110.727 176.083 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 162.16 -74.52 0.19 Allowed Glycine 0 CA--C 1.494 -1.23 0 N-CA-C 110.509 -1.036 . . . . 0.0 110.509 -175.909 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.635 ' OD1' HG13 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -163.23 120.72 1.23 Allowed Pre-proline 0 N--CA 1.436 -1.132 0 N-CA-C 115.543 1.683 . . . . 0.0 115.543 176.897 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.718 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 31.3 Cg_endo -116.33 155.08 0.03 OUTLIER 'Trans proline' 0 N--CA 1.437 -1.798 1 C-N-CA 125.348 4.032 . . . . 0.0 108.439 123.614 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.94 HD13 HD22 ' A' ' 66' ' ' LEU . 96.0 mt -118.45 103.81 15.18 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.721 0 C-N-CA 119.209 -0.997 . . . . 0.0 110.938 -177.535 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.706 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 36.0 mt-30 -92.9 123.31 36.07 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.979 177.199 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.668 HG21 HD13 ' A' ' 38' ' ' LEU . 27.1 m -139.68 170.3 15.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.164 -177.653 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -116.9 135.48 53.69 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.1 m -110.29 -41.24 4.45 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.673 -172.004 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.7 ttm180 -176.72 -37.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.747 -173.608 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -120.93 -53.44 2.06 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.879 0.371 . . . . 0.0 110.638 -174.464 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.6 t -142.31 175.07 10.05 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 -174.32 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.497 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 13.9 m -88.53 134.05 33.98 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-O 121.318 0.58 . . . . 0.0 110.624 -178.725 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.706 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 3.1 mm? -112.02 173.72 6.22 Favored 'General case' 0 C--N 1.317 -0.848 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.178 179.486 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.595 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -142.19 144.4 33.39 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.088 -178.416 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -154.36 -175.34 5.35 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 -178.612 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.415 ' HA ' ' HD3' ' A' ' 62' ' ' ARG . 19.6 mmt180 -107.42 160.27 15.76 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 122.208 1.004 . . . . 0.0 112.792 -178.445 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -56.0 -41.44 74.87 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 113.008 -1.905 . . . . 0.0 112.094 -179.544 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.552 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 42.8 tttp -66.97 -43.11 83.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.714 0.292 . . . . 0.0 110.489 -176.152 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -59.71 -40.68 88.75 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.145 177.809 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.94 HD22 HD13 ' A' ' 50' ' ' ILE . 10.4 tp -70.48 -39.02 74.48 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.632 179.566 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.74 -26.84 66.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.456 -179.208 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.632 ' HB3' ' HB ' ' A' ' 19' ' ' ILE . 94.6 mt -77.51 -7.65 56.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.983 0.421 . . . . 0.0 110.564 177.564 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.472 HD11 HD13 ' A' ' 32' ' ' LEU . 68.5 mt -99.02 140.91 32.47 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.662 174.342 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 28.7 m -85.74 114.05 22.4 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 172.741 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.567 HD11 ' HG ' ' A' ' 66' ' ' LEU . 68.9 mt -120.3 139.12 53.2 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.626 -174.332 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.418 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 28.5 m -127.0 129.52 23.97 Favored Pre-proline 0 C--N 1.318 -0.799 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.496 170.054 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.439 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 3.3 Cg_exo -75.65 162.43 35.46 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 122.108 1.872 . . . . 0.0 111.736 -179.289 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.425 HD12 ' HB2' ' A' ' 9' ' ' SER . 60.7 mt -69.78 -34.62 74.01 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.204 172.55 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 37.1 t70 . . . . . 0 C--O 1.25 1.121 0 CA-C-O 118.611 -0.709 . . . . 0.0 109.834 177.906 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 48.0 t . . . . . 0 N--CA 1.452 -0.337 0 CA-C-O 120.641 0.258 . . . . 0.0 111.104 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.408 ' H ' HG12 ' A' ' 40' ' ' VAL . 42.2 mtp85 -115.45 152.85 32.17 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.12 0.486 . . . . 0.0 111.475 -175.469 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.472 ' HB2' HD11 ' A' ' 74' ' ' LEU . 7.8 m -117.12 143.87 45.32 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.062 177.929 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 93.9 m-85 -128.89 140.03 51.87 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.813 0.339 . . . . 0.0 110.863 -175.655 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.61 ' HD3' ' HB2' ' A' ' 37' ' ' ALA . 28.7 mmt180 -83.75 150.91 25.51 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.829 175.21 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.597 HG12 ' CD2' ' A' ' 71' ' ' LEU . 46.0 mt -103.06 113.07 38.76 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 169.425 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 6.7 p -90.32 -11.68 40.01 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.06 0.457 . . . . 0.0 111.092 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 161.2 -158.33 30.0 Favored Glycine 0 N--CA 1.442 -0.955 0 C-N-CA 120.293 -0.956 . . . . 0.0 112.175 177.656 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 48.2 m-85 -114.99 150.17 36.23 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 -179.433 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.419 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 53.0 m -72.22 137.89 81.56 Favored Pre-proline 0 C--N 1.316 -0.884 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.424 -179.416 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 62.9 Cg_exo -52.88 156.3 9.63 Favored 'Trans proline' 0 C--O 1.237 0.474 0 C-N-CA 122.941 2.427 . . . . 0.0 112.548 178.396 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 17' ' ' PRO . . . 75.01 12.9 3.39 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.289 -177.143 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 16.0 tt -83.94 146.71 6.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.192 176.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.9 t -74.44 140.31 44.56 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 178.497 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -62.06 -49.83 74.4 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.917 -177.478 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.45 -31.27 80.32 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.976 -0.631 . . . . 0.0 112.359 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.446 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 21.5 t80 -72.59 -37.46 68.14 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.433 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.8 ttm180 -59.14 -43.0 91.99 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.759 172.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -66.04 -39.18 89.94 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.386 177.677 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.434 HH11 ' HD3' ' A' ' 26' ' ' ARG . 5.1 tpt180 -63.44 -39.31 94.14 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.019 178.268 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 23' ' ' TYR . 95.5 mt -66.58 -45.01 80.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.805 177.411 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -55.89 -47.77 76.82 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.3 176.848 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 50.3 m -60.93 -35.31 76.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.135 179.611 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 71.9 mtm -78.96 -14.98 58.89 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.75 -178.137 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 114.28 6.21 20.41 Favored Glycine 0 N--CA 1.453 -0.209 0 C-N-CA 120.331 -0.938 . . . . 0.0 113.026 175.676 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.665 HD13 HD11 ' A' ' 69' ' ' LEU . 82.6 mt -99.87 87.04 3.41 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 178.634 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.416 ' HB2' ' HD2' ' A' ' 34' ' ' PRO . 1.8 pt? -129.99 157.64 76.33 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.757 -177.186 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.416 ' HD2' ' HB2' ' A' ' 33' ' ' LEU . 18.0 Cg_endo -61.06 123.75 13.51 Favored 'Trans proline' 0 C--O 1.235 0.341 0 C-N-CA 122.534 2.156 . . . . 0.0 111.577 177.05 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 111.9 -17.43 24.98 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 121.04 -0.6 . . . . 0.0 111.856 -176.688 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -91.84 111.44 22.97 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.068 0.461 . . . . 0.0 110.234 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.61 ' HB2' ' HD3' ' A' ' 11' ' ' ARG . . . -90.37 129.06 36.62 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.828 177.353 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.417 ' N ' HD22 ' A' ' 38' ' ' LEU . 2.8 mm? -104.31 143.54 32.84 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.561 178.367 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 39' ' ' ARG . 36.1 ttm180 -105.21 124.62 49.85 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.339 176.482 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.408 HG12 ' H ' ' A' ' 8' ' ' ARG . 5.8 p -66.87 125.88 25.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.18 0.515 . . . . 0.0 110.377 -178.572 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 21.2 t -104.97 -39.46 5.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.543 -178.475 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 19.6 ttm180 -158.1 121.71 4.01 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 121.095 -0.242 . . . . 0.0 110.887 179.331 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.489 ' HA ' HG23 ' A' ' 50' ' ' ILE . 4.2 mp -97.42 130.37 46.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 178.514 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.461 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -75.58 134.69 72.5 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 174.824 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 24.7 Cg_exo -64.16 -4.34 7.58 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 123.113 2.542 . . . . 0.0 113.425 -174.96 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 7.0 mp -93.36 -20.83 19.97 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.663 0.268 . . . . 0.0 111.113 -179.151 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.62 -16.93 60.25 Favored Glycine 0 N--CA 1.453 -0.231 0 N-CA-C 110.774 -0.93 . . . . 0.0 110.774 -172.628 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.755 ' HB3' ' HD2' ' A' ' 49' ' ' PRO . 0.4 OUTLIER -69.43 170.05 10.39 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 114.72 -0.74 . . . . 0.0 109.594 171.726 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.827 ' HD3' ' HD3' ' A' ' 62' ' ' ARG . 5.6 Cg_exo -32.37 150.0 0.02 OUTLIER 'Trans proline' 0 C--N 1.361 1.209 0 C-N-CA 124.849 3.699 . . . . 0.0 116.718 -155.791 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.489 HG23 ' HA ' ' A' ' 43' ' ' ILE . 69.1 mt -124.07 134.22 67.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-N 113.684 -1.598 . . . . 0.0 109.634 -173.642 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.448 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 2.3 mp0 -78.76 120.69 23.76 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 177.686 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.457 ' O ' ' HA ' ' A' ' 58' ' ' SER . 27.3 m -128.4 160.01 39.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.666 -178.009 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -112.37 130.82 55.83 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.715 -173.213 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.5 t -104.09 -34.44 8.41 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.979 176.414 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 34.1 mtp180 -153.34 -89.35 0.05 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.526 177.687 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -112.89 0.79 15.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.484 -178.084 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.5 t -133.0 154.7 50.27 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.878 -177.422 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.457 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 7.2 m -104.92 139.21 39.97 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.663 -178.836 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.448 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 7.4 mp -118.0 173.23 6.89 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.942 178.0 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -142.52 141.78 32.13 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.667 0.27 . . . . 0.0 110.766 -179.53 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.476 ' O ' ' HA ' ' A' ' 49' ' ' PRO . 3.3 pp -143.97 150.99 39.16 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 178.638 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.827 ' HD3' ' HD3' ' A' ' 49' ' ' PRO . 32.1 mmt180 -73.77 174.16 8.82 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 121.382 0.611 . . . . 0.0 111.173 -176.761 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 63' ' ' ARG . 16.9 ptt180 -70.35 -33.7 71.77 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.895 179.464 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.445 ' HD2' ' C ' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -57.41 -47.4 81.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.074 174.14 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -68.28 -37.7 80.93 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.955 -177.776 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 38.8 tp -59.31 -38.94 81.54 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.842 177.372 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.93 -25.63 63.75 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.153 -178.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 82.0 mt -83.91 -8.6 59.14 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.23 -177.774 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.665 HD11 HD13 ' A' ' 32' ' ' LEU . 96.9 mt -103.86 132.7 49.86 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 110.251 -0.277 . . . . 0.0 110.251 178.036 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.0 m -89.43 114.18 25.62 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 175.225 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.597 ' CD2' HG12 ' A' ' 12' ' ' ILE . 73.6 mt -118.71 132.21 56.15 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.001 -173.391 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 27.2 m -122.06 132.77 24.19 Favored Pre-proline 0 C--N 1.318 -0.804 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.625 173.809 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -69.45 163.41 38.11 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 121.84 1.693 . . . . 0.0 112.426 -176.676 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.472 HD11 ' HB2' ' A' ' 9' ' ' SER . 85.9 mt -67.04 -14.97 63.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.732 173.116 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.6 t0 . . . . . 0 C--O 1.252 1.204 0 O-C-N 124.165 0.916 . . . . 0.0 110.318 -178.231 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.9 t . . . . . 0 N--CA 1.45 -0.468 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 -155.79 144.77 20.58 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 176.043 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.533 ' HB2' HD11 ' A' ' 74' ' ' LEU . 15.1 m -90.94 140.7 29.58 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 -179.598 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -124.27 142.22 51.43 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.843 0.354 . . . . 0.0 110.7 -175.656 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.597 ' HG3' HD23 ' A' ' 74' ' ' LEU . 90.6 mtt-85 -99.05 157.25 16.47 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.717 175.422 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 49.7 mt -94.07 112.99 27.85 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.739 179.006 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.96 -33.35 70.38 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.434 0.635 . . . . 0.0 110.156 178.154 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.555 ' HA2' ' HB3' ' A' ' 34' ' ' PRO . . . 153.94 -147.36 16.59 Favored Glycine 0 N--CA 1.444 -0.807 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.329 -179.655 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -113.61 160.56 18.43 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 -179.426 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.441 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 34.0 t -62.8 133.01 94.96 Favored Pre-proline 0 C--N 1.321 -0.665 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 172.588 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 31.7 Cg_exo -60.1 -16.53 40.2 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.895 2.396 . . . . 0.0 112.727 -178.683 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -103.6 24.33 11.3 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.081 -178.094 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 18.4 tt -71.2 155.01 7.67 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 175.564 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.1 p -124.24 127.15 47.26 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -172.113 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.417 ' HB3' ' H ' ' A' ' 22' ' ' GLY . 16.7 m120 64.94 -156.32 0.29 Allowed 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.222 -0.899 . . . . 0.0 112.478 168.615 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.417 ' H ' ' HB3' ' A' ' 21' ' ' ASN . . . -75.14 15.09 4.39 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 115.337 -0.847 . . . . 0.0 113.356 -175.856 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.406 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 29.1 t80 -61.95 -36.09 80.38 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 174.909 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 4.4 tmm_? -64.62 -39.77 94.29 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.373 175.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -68.58 -35.31 77.2 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.246 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -64.4 -41.44 96.64 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.691 176.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.825 HD13 HD21 ' A' ' 69' ' ' LEU . 83.7 mt -67.17 -43.66 81.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.186 177.231 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -59.5 -44.58 93.05 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.502 178.677 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.3 m -64.24 -33.77 76.58 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.886 179.144 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 70.4 mtm -78.12 -16.47 57.93 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.327 -178.163 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 112.78 11.87 13.7 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.427 -0.892 . . . . 0.0 113.013 174.774 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 94.4 mt -100.63 95.9 7.0 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.794 0.331 . . . . 0.0 110.321 179.447 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -132.52 152.81 80.66 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.686 -179.508 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.555 ' HB3' ' HA2' ' A' ' 14' ' ' GLY . 24.0 Cg_endo -62.4 139.14 75.22 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.855 2.37 . . . . 0.0 112.132 179.11 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 107.36 -26.33 18.84 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.298 178.671 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.07 -172.47 4.15 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 121.141 0.496 . . . . 0.0 110.212 -178.51 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.563 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -145.28 144.06 30.55 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.066 -176.606 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.419 HD13 HG21 ' A' ' 52' ' ' VAL . 84.1 mt -118.47 137.82 52.92 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.687 178.013 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 40.2 ttt85 -101.71 117.62 35.25 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.546 ' HA ' HG12 ' A' ' 52' ' ' VAL . 14.5 p -62.48 127.1 21.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.66 0.743 . . . . 0.0 111.707 -176.253 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 91.6 t -90.4 -61.26 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.969 170.959 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 50.1 mtp180 -167.13 155.43 9.69 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 123.72 0.638 . . . . 0.0 111.597 -177.943 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.485 HG23 ' HD2' ' A' ' 49' ' ' PRO . 3.3 mp -117.15 116.7 52.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 163.565 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -54.13 135.02 59.29 Favored Pre-proline 0 C--N 1.326 -0.416 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -67.86 -1.58 7.12 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.812 2.341 . . . . 0.0 112.141 179.133 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.42 HD13 ' HA ' ' A' ' 46' ' ' LEU . 3.9 mm? -63.8 -28.8 70.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.577 174.268 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 157.46 -76.59 0.2 Allowed Glycine 0 N--CA 1.438 -1.181 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.939 -176.408 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -167.78 120.01 0.72 Allowed Pre-proline 0 N--CA 1.448 -0.543 0 N-CA-C 113.882 1.067 . . . . 0.0 113.882 176.567 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.485 ' HD2' HG23 ' A' ' 43' ' ' ILE . 81.1 Cg_endo -118.67 -168.72 0.02 OUTLIER 'Trans proline' 0 N--CA 1.433 -2.055 1 C-N-CA 126.372 4.715 . . . . 0.0 108.243 140.318 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.741 HD12 HD11 ' A' ' 61' ' ' LEU . 62.6 mt -140.67 100.62 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 168.869 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.439 ' OE1' ' HB2' ' A' ' 60' ' ' ALA . 5.3 tp60 -86.93 116.52 25.04 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 178.478 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.546 HG12 ' HA ' ' A' ' 40' ' ' VAL . 11.5 m -136.79 175.97 8.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.528 0.204 . . . . 0.0 110.56 -177.851 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.44 ' HG2' ' H ' ' A' ' 55' ' ' ARG . 40.8 tt0 -147.17 138.88 24.19 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 176.065 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -86.16 27.23 0.93 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.093 0.473 . . . . 0.0 109.912 176.745 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.44 ' H ' ' HG2' ' A' ' 53' ' ' GLU . 43.3 ttm105 67.1 16.01 10.19 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 121.904 0.859 . . . . 0.0 109.923 -175.833 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -139.42 -70.55 0.4 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.382 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 17.0 m -114.61 141.65 47.5 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.046 177.794 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 23.1 p -85.32 146.98 26.76 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.954 0.407 . . . . 0.0 110.491 176.804 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 15.9 mt -141.19 167.35 22.38 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.639 -179.131 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.499 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -137.93 154.77 49.38 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 114.678 -1.146 . . . . 0.0 109.873 -179.385 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.741 HD11 HD12 ' A' ' 50' ' ' ILE . 1.3 pp -157.31 168.3 27.78 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 -179.785 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.648 ' HD3' ' OD2' ' A' ' 65' ' ' ASP . 0.1 OUTLIER -107.63 172.49 6.8 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.042 0.449 . . . . 0.0 110.329 -176.899 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.504 ' HG3' ' N ' ' A' ' 64' ' ' LYS . 0.2 OUTLIER -59.97 -34.03 72.74 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.549 174.258 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.504 ' N ' ' HG3' ' A' ' 63' ' ' ARG . 1.5 tmtp? -62.5 -40.91 98.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.969 -1.014 . . . . 0.0 110.297 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.648 ' OD2' ' HD3' ' A' ' 62' ' ' ARG . 26.1 m-20 -72.94 -37.86 66.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.797 179.168 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 53.0 tp -61.27 -31.63 71.45 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.481 177.627 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.11 -10.9 60.41 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.302 178.695 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 95.9 mt -110.59 -5.29 15.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.962 0.411 . . . . 0.0 110.815 179.416 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.825 HD21 HD13 ' A' ' 27' ' ' LEU . 98.7 mt -123.53 125.29 44.62 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.623 -177.67 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 6.7 m -91.53 114.25 26.73 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.009 0.433 . . . . 0.0 110.065 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 8.9 mp -125.65 143.61 50.96 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.466 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 15.6 m -137.23 159.15 70.82 Favored Pre-proline 0 C--N 1.32 -0.697 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.643 178.143 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -61.29 167.64 9.09 Favored 'Trans proline' 0 C--O 1.234 0.284 0 C-N-CA 122.206 1.938 . . . . 0.0 112.068 177.482 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.597 HD23 ' HG3' ' A' ' 11' ' ' ARG . 86.3 mt -54.42 -56.25 20.57 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.985 0.421 . . . . 0.0 110.383 176.441 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.6 t0 . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.259 -0.876 . . . . 0.0 109.287 177.858 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 38.5 t . . . . . 0 N--CA 1.449 -0.493 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.411 ' O ' HG12 ' A' ' 40' ' ' VAL . 87.9 mtt180 -133.68 179.67 6.09 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 121.384 0.612 . . . . 0.0 110.884 -179.08 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 37.3 m -124.59 129.64 50.95 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.085 176.211 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -113.99 149.18 35.72 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.917 0.389 . . . . 0.0 110.87 -174.262 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 78.7 mtp180 -105.46 153.24 21.98 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 174.75 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.662 HD12 ' HB3' ' A' ' 36' ' ' ALA . 35.2 mt -97.2 105.58 17.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 177.354 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.66 -31.45 71.46 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.4 0.619 . . . . 0.0 110.188 179.059 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 160.09 -153.49 24.46 Favored Glycine 0 N--CA 1.443 -0.89 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.311 -178.852 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 66.2 m-85 -99.38 162.39 13.07 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 179.467 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.7 t -69.63 132.67 89.05 Favored Pre-proline 0 C--N 1.317 -0.845 0 N-CA-C 109.103 -0.702 . . . . 0.0 109.103 172.23 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -63.33 -7.07 11.29 Favored 'Trans proline' 0 C--O 1.233 0.255 0 C-N-CA 122.595 2.197 . . . . 0.0 112.67 -178.138 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.37 1.71 56.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.287 178.713 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 14.7 tt -75.12 146.75 9.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 179.129 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.7 t -160.37 -178.95 7.28 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 121.166 -0.214 . . . . 0.0 110.451 -177.193 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.4 t30 70.78 7.4 6.2 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 123.731 0.812 . . . . 0.0 111.767 175.663 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.7 14.13 61.79 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.542 -0.837 . . . . 0.0 113.051 177.117 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -65.28 -24.16 67.23 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.002 0.429 . . . . 0.0 110.085 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.411 HH11 ' HD3' ' A' ' 24' ' ' ARG . 25.8 ttt180 -53.1 -48.66 67.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.578 173.566 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 83.5 mt-30 -64.98 -28.17 69.33 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.353 -179.576 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 26.5 tpt180 -74.33 -40.96 61.84 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.852 176.543 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.68 HD22 HD12 ' A' ' 32' ' ' LEU . 46.1 mt -66.91 -42.1 86.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.755 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -59.72 -43.15 94.29 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.923 177.081 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 70.1 m -63.15 -30.69 71.79 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.323 177.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 89.3 mtp -80.23 -16.18 55.34 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.218 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 108.98 10.82 23.76 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.479 -0.867 . . . . 0.0 112.647 176.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.903 HD13 HD11 ' A' ' 69' ' ' LEU . 84.8 mt -101.42 100.11 10.54 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.961 0.41 . . . . 0.0 109.925 179.374 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.408 ' H ' HD23 ' A' ' 33' ' ' LEU . 1.9 pt? -131.8 156.12 80.52 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.817 -177.463 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -64.69 125.44 14.88 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.719 2.28 . . . . 0.0 111.473 176.137 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 109.55 -1.07 30.73 Favored Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.652 -0.785 . . . . 0.0 112.838 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.662 ' HB3' HD12 ' A' ' 12' ' ' ILE . . . -88.4 -172.75 3.9 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 120.989 0.423 . . . . 0.0 110.046 178.807 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -158.13 146.88 19.09 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.455 -177.427 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.437 HD13 HG21 ' A' ' 52' ' ' VAL . 82.5 mt -137.74 139.85 40.35 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.925 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 52.5 ttm-85 -101.72 124.85 48.05 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 175.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.603 ' HA ' HG12 ' A' ' 52' ' ' VAL . 9.3 p -75.88 122.69 30.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.522 0.677 . . . . 0.0 110.622 -177.239 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.599 HG12 ' HG3' ' A' ' 42' ' ' ARG . 48.9 t -93.73 -52.9 9.13 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.36 178.279 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.599 ' HG3' HG12 ' A' ' 41' ' ' VAL . 96.5 mtt180 -152.74 140.39 19.86 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -174.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.453 HD11 HG21 ' A' ' 40' ' ' VAL . 4.5 mp -116.27 144.22 24.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 164.783 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.603 ' H ' ' CD ' ' A' ' 49' ' ' PRO . . . -81.94 138.36 46.42 Favored Pre-proline 0 C--N 1.318 -0.785 0 CA-C-N 117.788 0.267 . . . . 0.0 110.923 178.645 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -66.14 -5.31 12.07 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 123.24 2.626 . . . . 0.0 112.56 179.489 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -65.53 -35.89 82.2 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.206 174.587 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 158.65 -77.49 0.19 Allowed Glycine 0 N--CA 1.438 -1.226 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.037 -176.197 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -153.62 120.03 2.88 Favored Pre-proline 0 N--CA 1.445 -0.724 0 N-CA-C 114.501 1.297 . . . . 0.0 114.501 179.302 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.603 ' CD ' ' H ' ' A' ' 44' ' ' ALA . 94.6 Cg_endo -119.51 -173.51 0.02 OUTLIER 'Trans proline' 0 N--CA 1.436 -1.854 1 C-N-CA 126.482 4.788 . . . . 0.0 107.693 131.301 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.732 HG22 HG13 ' A' ' 52' ' ' VAL . 57.1 mt -142.1 100.85 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.425 0 C-N-CA 119.749 -0.78 . . . . 0.0 109.942 170.81 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.57 112.57 22.41 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 178.437 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.732 HG13 HG22 ' A' ' 50' ' ' ILE . 24.2 m -129.41 -177.12 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.831 0.348 . . . . 0.0 110.59 -177.058 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -133.74 132.1 40.18 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 174.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.4 m -76.79 -30.98 56.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.082 0.467 . . . . 0.0 110.931 -176.69 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.408 ' HD3' HH11 ' A' ' 55' ' ' ARG . 9.3 ptp180 173.72 -26.26 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.642 -178.406 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -155.25 -36.73 0.09 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.166 -179.845 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.7 t -96.88 141.73 29.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.416 -179.383 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 45.4 m -80.95 146.59 30.67 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.618 178.445 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.8 tp -138.62 159.92 40.9 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.296 -179.608 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.572 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -138.94 156.84 46.93 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.927 -0.398 . . . . 0.0 109.927 177.74 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.656 HD11 HD12 ' A' ' 50' ' ' ILE . 3.7 pp -161.94 168.8 22.28 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -178.119 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.648 ' HD3' ' OD2' ' A' ' 65' ' ' ASP . 0.0 OUTLIER -109.43 169.04 8.95 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.448 0.642 . . . . 0.0 111.293 -177.603 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.572 ' HD2' ' N ' ' A' ' 64' ' ' LYS . 2.0 ppt_? -58.35 -33.25 69.35 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.69 -1.141 . . . . 0.0 111.796 176.223 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.572 ' N ' ' HD2' ' A' ' 63' ' ' ARG . 88.6 tttt -63.96 -44.61 92.27 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.489 176.406 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.648 ' OD2' ' HD3' ' A' ' 62' ' ' ARG . 23.3 m-20 -65.94 -36.8 84.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.287 0.565 . . . . 0.0 109.596 177.757 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.3 tp -59.25 -35.68 74.12 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.621 175.375 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.87 -10.48 58.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.622 -178.272 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 78.5 mt -94.84 -13.85 25.15 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.958 0.409 . . . . 0.0 110.444 178.647 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.903 HD11 HD13 ' A' ' 32' ' ' LEU . 96.7 mt -115.03 150.08 36.44 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.071 0.462 . . . . 0.0 110.865 -177.615 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 22.6 m -108.51 118.89 37.95 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.368 -0.605 . . . . 0.0 109.368 170.686 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 77.9 mt -120.02 138.41 53.53 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.99 -174.602 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.427 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 19.7 m -130.73 134.42 25.99 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.659 174.954 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 72' ' ' VAL . 27.7 Cg_exo -62.07 164.59 16.55 Favored 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 122.283 1.989 . . . . 0.0 112.103 179.499 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 96.0 mt -53.25 -42.1 66.13 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.538 175.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 33.9 t70 . . . . . 0 C--O 1.247 0.962 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.77 177.607 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 29.7 t . . . . . 0 N--CA 1.453 -0.302 0 CA-C-O 120.45 0.167 . . . . 0.0 111.176 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.413 ' HD2' ' HA ' ' A' ' 8' ' ' ARG . 0.5 OUTLIER -93.66 164.88 12.98 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.99 0.424 . . . . 0.0 110.487 -177.057 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.462 ' OG ' ' HG3' ' A' ' 39' ' ' ARG . 16.6 m -132.51 139.18 47.81 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.886 178.386 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.402 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 59.3 m-85 -120.4 133.44 55.43 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.116 -177.965 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.66 HH11 ' HB2' ' A' ' 37' ' ' ALA . 21.8 mmm180 -89.21 148.52 23.57 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 178.33 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.54 HG12 ' CD2' ' A' ' 71' ' ' LEU . 47.7 mt -102.42 113.06 37.87 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 175.364 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 4.5 p -81.21 -23.37 38.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.859 0.361 . . . . 0.0 110.904 179.472 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 161.75 -145.89 11.43 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 120.457 -0.878 . . . . 0.0 112.102 -178.469 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -117.99 154.55 31.78 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.161 0.505 . . . . 0.0 110.889 -175.72 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.435 ' O ' HG22 ' A' ' 19' ' ' ILE . 43.3 t -73.64 139.99 78.05 Favored Pre-proline 0 C--N 1.318 -0.782 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.319 174.148 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 31.3 Cg_exo -60.5 -8.73 9.43 Favored 'Trans proline' 0 N--CA 1.475 0.398 0 C-N-CA 123.152 2.568 . . . . 0.0 113.341 -178.814 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.63 -6.36 58.93 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.515 179.669 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.435 HG22 ' O ' ' A' ' 16' ' ' SER . 16.5 tt -79.23 139.47 18.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-O 120.909 0.385 . . . . 0.0 110.006 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.8 p -153.41 170.97 19.4 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -176.122 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 65.9 t30 67.62 38.01 3.17 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.578 172.663 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.94 21.04 75.12 Favored Glycine 0 N--CA 1.454 -0.136 0 C-N-CA 121.027 -0.606 . . . . 0.0 113.594 174.225 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.416 ' HB3' ' CG1' ' A' ' 19' ' ' ILE . 7.3 t80 -66.83 -22.83 65.99 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.829 0.347 . . . . 0.0 110.446 -177.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 32.1 mtp180 -64.52 -40.89 96.45 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.663 175.571 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -69.12 -35.52 76.5 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 120.989 0.423 . . . . 0.0 110.141 179.401 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -66.06 -42.18 89.78 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.872 177.61 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.566 HD22 HD12 ' A' ' 32' ' ' LEU . 61.2 mt -70.97 -34.95 71.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.537 -179.785 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -58.46 -44.32 89.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.35 176.405 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 49.3 m -61.44 -35.34 77.31 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.806 178.702 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 91.9 mtp -75.79 -36.34 59.78 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.51 -178.449 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.04 14.97 5.34 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.202 -178.265 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.566 HD12 HD22 ' A' ' 27' ' ' LEU . 94.5 mt -104.46 91.98 4.12 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.911 0.386 . . . . 0.0 110.25 179.375 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.491 ' HB2' ' HD2' ' A' ' 34' ' ' PRO . 1.7 pt? -137.83 160.54 64.35 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.392 -179.224 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.491 ' HD2' ' HB2' ' A' ' 33' ' ' LEU . 13.8 Cg_endo -57.44 129.99 36.78 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.797 2.331 . . . . 0.0 111.659 176.716 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 110.75 -17.27 27.93 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.227 -177.225 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.66 100.55 12.9 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.913 0.387 . . . . 0.0 110.714 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.66 ' HB2' HH11 ' A' ' 11' ' ' ARG . . . -75.8 134.55 40.37 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.906 177.421 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 34.7 mt -110.21 135.91 50.25 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.567 -178.744 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.565 ' HB2' ' HB3' ' A' ' 53' ' ' GLU . 0.3 OUTLIER -94.55 147.44 23.27 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 172.928 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 11.8 p -85.15 124.11 39.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-O 120.831 0.348 . . . . 0.0 111.036 -176.318 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 96.0 t -102.63 -50.19 9.93 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 C-N-CA 120.776 -0.37 . . . . 0.0 110.678 173.727 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.401 ' HB2' ' HE ' ' A' ' 42' ' ' ARG . 2.1 ttm180 -177.12 158.04 1.46 Allowed 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -175.801 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.403 HG23 ' CB ' ' A' ' 48' ' ' ASP . 46.7 mm -129.85 141.7 45.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 170.657 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.504 ' HB2' ' CD ' ' A' ' 49' ' ' PRO . . . -65.63 152.54 92.51 Favored Pre-proline 0 N--CA 1.469 0.522 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -179.49 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -69.07 -32.1 22.17 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 122.728 2.285 . . . . 0.0 112.616 175.66 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.413 HD13 ' HA ' ' A' ' 46' ' ' LEU . 4.0 mm? -65.51 -88.58 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.809 0.814 . . . . 0.0 110.45 177.095 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.542 ' O ' ' HB3' ' A' ' 48' ' ' ASP . . . -115.08 -79.27 0.82 Allowed Glycine 0 N--CA 1.432 -1.602 0 N-CA-C 109.119 -1.592 . . . . 0.0 109.119 169.305 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.559 ' OD1' ' HD3' ' A' ' 63' ' ' ARG . 6.0 p-10 166.98 133.3 0.04 OUTLIER Pre-proline 0 N--CA 1.451 -0.423 0 N-CA-C 113.925 1.083 . . . . 0.0 113.925 -178.901 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.504 ' CD ' ' HB2' ' A' ' 44' ' ' ALA . 7.5 Cg_endo -96.65 152.09 1.17 Allowed 'Trans proline' 0 N--CA 1.432 -2.134 0 N-CA-C 106.828 -2.028 . . . . 0.0 106.828 132.501 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.729 HD13 HD22 ' A' ' 66' ' ' LEU . 62.1 mt -106.23 100.69 11.15 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.695 0 C-N-CA 119.566 -0.853 . . . . 0.0 110.092 -173.802 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -82.4 117.0 22.13 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.711 178.434 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.521 HG13 HG22 ' A' ' 50' ' ' ILE . 31.1 m -137.4 172.51 14.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.04 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.565 ' HB3' ' HB2' ' A' ' 39' ' ' ARG . 42.9 tt0 -123.18 123.02 39.85 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 176.121 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.7 p -85.14 -30.79 23.7 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.795 -173.091 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 46.8 ttp180 -174.17 -46.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.861 0.362 . . . . 0.0 110.862 179.546 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 21.9 mt-30 -134.37 -27.13 1.39 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.747 -175.166 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.8 t -125.8 160.64 29.3 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.852 0.358 . . . . 0.0 111.016 -176.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.3 m -86.08 142.93 28.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.276 177.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 10.3 tt -137.96 145.24 41.75 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.086 -178.587 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.539 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -121.74 143.51 49.33 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.414 179.054 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.2 pp -150.87 176.55 10.98 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 -178.705 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -96.42 156.15 16.46 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.477 0.655 . . . . 0.0 111.704 -177.609 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.559 ' HD3' ' OD1' ' A' ' 48' ' ' ASP . 28.0 ptt-85 -65.11 -33.61 76.43 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.664 179.266 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -55.43 -43.95 75.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.28 176.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -68.47 -39.46 81.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.555 177.65 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.926 HD11 HD11 ' A' ' 71' ' ' LEU . 18.6 tp -65.45 -29.04 69.67 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.987 -179.541 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.65 -15.91 63.67 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.84 178.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.43 ' HA ' ' HB3' ' A' ' 16' ' ' SER . 93.5 mt -96.92 -3.72 41.31 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.697 178.371 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.2 mt -110.3 130.0 55.63 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.133 178.816 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 31.4 m -92.1 116.41 28.91 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.348 0.594 . . . . 0.0 110.416 177.18 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.926 HD11 HD11 ' A' ' 66' ' ' LEU . 77.2 mt -108.57 144.77 35.82 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.102 -176.449 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.419 HG23 ' HB2' ' A' ' 11' ' ' ARG . 15.9 m -132.33 119.23 16.37 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.505 170.975 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 23.5 Cg_exo -63.5 163.15 24.9 Favored 'Trans proline' 0 C--O 1.237 0.473 0 C-N-CA 122.209 1.939 . . . . 0.0 112.293 -178.165 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.416 ' CD1' ' HB2' ' A' ' 9' ' ' SER . 61.0 mt -65.68 -30.4 71.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.335 173.325 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 . . . . . 0 C--O 1.251 1.132 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.779 178.443 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.5 m . . . . . 0 N--CA 1.44 -0.964 0 CA-C-O 121.002 0.43 . . . . 0.0 110.446 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.6 mtt180 -155.18 157.13 36.91 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.499 -178.403 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.532 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 39.1 m -122.57 130.27 52.83 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.837 -1.074 . . . . 0.0 108.513 170.118 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -110.5 142.03 42.83 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.373 -177.545 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 12.9 ptt180 -108.05 148.67 29.45 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.303 0.573 . . . . 0.0 110.493 177.94 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.568 HG12 ' CD2' ' A' ' 71' ' ' LEU . 22.4 mt -90.2 113.34 26.12 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.618 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 10.5 t -91.13 -11.04 39.72 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.744 -0.382 . . . . 0.0 111.143 -178.062 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.666 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 161.36 -168.47 36.6 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.343 -0.932 . . . . 0.0 112.211 177.295 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -98.54 157.06 16.47 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 177.697 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.4 t -59.24 140.16 87.9 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.642 175.457 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -65.17 -14.57 45.85 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.271 1.981 . . . . 0.0 111.596 175.604 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -102.69 12.66 36.0 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.14 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.506 HG13 HD22 ' A' ' 68' ' ' LEU . 12.3 tt -76.27 146.24 9.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.126 0.489 . . . . 0.0 111.006 -177.556 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.571 ' HB2' ' HD2' ' A' ' 23' ' ' TYR . 20.4 m -84.03 145.61 28.4 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.861 175.707 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -57.25 -43.08 82.66 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.021 0.378 . . . . 0.0 112.021 -175.547 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -67.51 -35.83 87.4 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.24 -179.622 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.571 ' HD2' ' HB2' ' A' ' 20' ' ' SER . 19.2 m-85 -67.49 -35.3 78.88 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 122.847 -0.208 . . . . 0.0 110.776 177.688 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 74.2 ttt-85 -62.55 -40.25 96.24 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 174.86 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -66.59 -40.67 88.99 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.704 177.358 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 52.9 ttt180 -61.29 -45.46 94.4 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.345 176.301 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 23' ' ' TYR . 66.9 mt -65.95 -42.84 89.48 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.604 -178.139 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -60.83 -43.32 98.42 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.949 178.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 59.2 m -66.78 -29.59 69.57 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.381 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 84.2 mtp -77.91 -18.11 56.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.037 177.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 103.38 15.01 24.42 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.374 178.799 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.565 HD13 HD11 ' A' ' 69' ' ' LEU . 92.3 mt -100.93 97.94 8.47 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.008 0.432 . . . . 0.0 110.117 -179.52 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.401 HD23 ' H ' ' A' ' 33' ' ' LEU . 1.9 pt? -132.9 159.2 73.56 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.133 -177.851 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.666 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 37.1 Cg_exo -60.47 128.58 26.48 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.653 2.236 . . . . 0.0 111.455 176.361 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 115.37 -12.73 18.92 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 120.668 -0.777 . . . . 0.0 111.891 -176.741 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.5 ' HB3' HD12 ' A' ' 12' ' ' ILE . . . -89.41 176.47 6.9 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-O 121.329 0.585 . . . . 0.0 110.09 179.156 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -147.19 150.65 35.32 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.134 -177.431 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 55.3 mt -127.53 131.34 50.07 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.66 177.703 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -107.67 127.69 53.89 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.704 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 14.7 p -62.17 124.72 17.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.174 0.511 . . . . 0.0 111.592 -176.08 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 85.1 t -97.26 -52.92 8.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.696 173.077 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 38.6 mtp-105 -151.54 157.01 41.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.137 179.404 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.478 HG12 HG23 ' A' ' 50' ' ' ILE . 64.9 mt -127.65 131.87 69.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 176.252 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.459 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -65.13 141.41 98.28 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.384 178.565 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 32.0 Cg_exo -59.24 -16.0 31.9 Favored 'Trans proline' 0 N--CA 1.476 0.48 0 C-N-CA 123.259 2.639 . . . . 0.0 113.65 -174.588 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.428 HD22 ' N ' ' A' ' 46' ' ' LEU . 2.2 mm? -89.12 -16.98 30.16 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.702 0.287 . . . . 0.0 111.202 -177.563 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.72 -16.86 60.39 Favored Glycine 0 N--CA 1.454 -0.125 0 N-CA-C 111.016 -0.833 . . . . 0.0 111.016 -174.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.905 ' HB3' ' HD2' ' A' ' 49' ' ' PRO . 1.5 m-20 -65.62 170.6 4.56 Favored Pre-proline 0 C--N 1.326 -0.448 0 C-N-CA 123.601 0.761 . . . . 0.0 110.616 173.346 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.905 ' HD2' ' HB3' ' A' ' 48' ' ' ASP . 23.3 Cg_exo -19.77 151.38 0.0 OUTLIER 'Trans proline' 0 C--N 1.366 1.459 1 C-N-CA 126.675 4.917 . . . . 0.0 117.434 -163.693 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.497 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 62.3 mt -123.6 138.8 52.18 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 CA-C-N 113.862 -1.517 . . . . 0.0 110.604 -166.89 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 27.8 mp0 -86.04 119.35 26.25 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 175.301 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 28.3 m -130.83 159.11 43.11 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.824 -176.271 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -116.41 141.83 47.66 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 -178.401 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.43 ' O ' ' HB2' ' A' ' 55' ' ' ARG . 35.4 p -97.69 -45.15 6.48 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.356 0.598 . . . . 0.0 109.879 179.438 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.43 ' HB2' ' O ' ' A' ' 54' ' ' THR . 0.0 OUTLIER 167.66 -46.46 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 114.508 -1.224 . . . . 0.0 107.971 -173.238 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.53 -54.91 2.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.0 -175.706 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.9 t -126.86 144.34 51.01 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.041 -172.871 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 9.9 m -91.62 139.27 30.86 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.643 -178.689 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.7 mp -121.14 168.91 11.06 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.789 -178.194 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.497 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -142.18 124.9 15.93 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.321 175.019 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.576 ' HB2' ' HB2' ' A' ' 65' ' ' ASP . 3.5 pp -126.56 146.66 50.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.642 -173.119 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.715 ' HG3' ' HG3' ' A' ' 49' ' ' PRO . 1.0 OUTLIER -86.97 178.04 7.06 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.555 -175.172 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 44.5 mtt180 -54.73 -39.35 68.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.764 174.716 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.487 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 84.2 tttt -61.76 -50.68 71.39 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.86 179.053 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.576 ' HB2' ' HB2' ' A' ' 61' ' ' LEU . 24.8 m-20 -64.67 -40.05 94.73 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.928 -178.23 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 49.7 tp -59.96 -43.43 95.05 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.07 177.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.9 -13.93 62.2 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -177.487 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.506 HD22 HG13 ' A' ' 19' ' ' ILE . 97.3 mt -80.11 -28.05 39.09 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.723 0.297 . . . . 0.0 110.607 178.14 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.565 HD11 HD13 ' A' ' 32' ' ' LEU . 96.0 mt -104.71 140.86 37.45 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.414 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.9 m -92.11 113.12 25.3 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 170.805 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.568 ' CD2' HG12 ' A' ' 12' ' ' ILE . 89.6 mt -113.28 133.4 55.12 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.608 -174.689 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 17.1 m -129.71 142.02 43.86 Favored Pre-proline 0 C--N 1.316 -0.855 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.561 174.805 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -67.87 163.24 36.28 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 121.764 1.643 . . . . 0.0 111.416 179.38 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' A' ' 9' ' ' SER . 75.4 mt -59.02 -63.38 1.32 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.741 175.542 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.06 -0.972 . . . . 0.0 110.007 178.965 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.8 t . . . . . 0 N--CA 1.448 -0.543 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 54.4 mtt180 -147.12 175.22 10.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.013 0.435 . . . . 0.0 110.611 176.19 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.1 t -114.17 135.67 53.79 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 174.785 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -119.92 146.58 45.66 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 -174.68 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.471 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 2.5 ptp180 -104.09 147.17 27.72 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.133 0.492 . . . . 0.0 110.424 178.543 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.564 HG12 ' CD2' ' A' ' 71' ' ' LEU . 46.9 mt -86.28 113.39 24.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.797 178.055 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 3.5 m -68.4 -35.3 77.45 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.266 0.555 . . . . 0.0 110.146 178.26 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.424 ' HA2' ' HB3' ' A' ' 34' ' ' PRO . . . 159.15 -153.25 24.34 Favored Glycine 0 N--CA 1.44 -1.087 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.112 -178.394 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -100.5 151.62 21.35 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 120.908 0.385 . . . . 0.0 110.098 179.631 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.427 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 27.9 t -72.14 140.06 82.6 Favored Pre-proline 0 C--N 1.317 -0.833 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.557 176.805 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 43.5 Cg_exo -57.92 -21.03 47.32 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.664 2.243 . . . . 0.0 112.407 179.121 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.14 16.06 15.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.514 -177.644 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.522 HD11 HD12 ' A' ' 27' ' ' LEU . 15.7 tt -72.23 154.76 7.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.691 0.281 . . . . 0.0 110.412 179.34 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 21.6 t -84.05 143.78 29.51 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.875 0.369 . . . . 0.0 110.683 -178.051 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -64.3 132.33 49.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.472 178.872 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.98 -33.69 3.73 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 121.047 -0.596 . . . . 0.0 111.754 -177.471 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.406 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 61.4 t80 -65.83 -35.84 81.81 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.369 0.604 . . . . 0.0 109.539 176.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' A' ' 24' ' ' ARG . 12.3 ttm180 -58.83 -43.11 90.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.047 174.087 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -66.1 -36.5 83.33 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.699 -179.183 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.412 ' O ' ' HG3' ' A' ' 30' ' ' MET . 39.4 ttm180 -67.93 -40.4 83.35 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.298 176.59 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.57 HD13 HD21 ' A' ' 69' ' ' LEU . 64.2 mt -65.04 -43.68 91.54 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.258 179.248 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -58.1 -46.47 85.48 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.224 175.291 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.8 t -61.16 -32.86 72.59 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.344 -0.843 . . . . 0.0 110.886 179.068 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.412 ' HG3' ' O ' ' A' ' 26' ' ' ARG . 89.4 mtp -74.65 -22.16 59.04 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.863 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 109.04 16.56 11.21 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.592 -0.813 . . . . 0.0 112.342 178.873 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.459 HD13 HD11 ' A' ' 69' ' ' LEU . 81.9 mt -104.04 96.96 7.01 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 178.797 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.47 ' HB2' ' HD2' ' A' ' 34' ' ' PRO . 1.8 pt? -135.67 161.09 64.98 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.342 -177.124 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.47 ' HD2' ' HB2' ' A' ' 33' ' ' LEU . 19.8 Cg_endo -59.8 131.43 39.8 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.43 2.087 . . . . 0.0 111.138 174.681 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.28 9.37 39.08 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.546 -0.835 . . . . 0.0 112.244 -178.695 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.553 ' O ' HG13 ' A' ' 12' ' ' ILE . . . -111.9 125.63 54.24 Favored 'General case' 0 N--CA 1.445 -0.72 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 177.35 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.471 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -99.75 138.69 36.48 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 121.12 0.486 . . . . 0.0 111.263 178.167 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 64.1 mt -119.44 141.63 48.95 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.396 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.487 ' HD3' ' HB3' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -99.32 154.08 18.46 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 173.607 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 12.5 p -95.97 128.54 47.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-O 121.314 0.578 . . . . 0.0 110.871 -177.045 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 92.8 t -88.06 -52.22 11.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.538 175.607 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 50.5 mtp180 -158.25 136.4 10.79 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.699 179.148 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.404 HD12 ' N ' ' A' ' 43' ' ' ILE . 4.2 mp -96.73 129.51 46.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 172.87 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.448 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -69.38 131.28 90.26 Favored Pre-proline 0 C--N 1.324 -0.505 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 176.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 20.1 Cg_exo -66.36 4.58 0.94 Allowed 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 123.053 2.502 . . . . 0.0 113.089 -176.026 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -101.29 -23.67 14.36 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.48 179.14 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 97.91 -15.9 61.02 Favored Glycine 0 N--CA 1.453 -0.182 0 N-CA-C 110.536 -1.026 . . . . 0.0 110.536 -171.388 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.628 ' CB ' ' HD2' ' A' ' 49' ' ' PRO . 0.6 OUTLIER -64.85 170.29 4.25 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 114.488 -0.856 . . . . 0.0 109.888 170.901 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.669 ' HD3' ' HD3' ' A' ' 62' ' ' ARG . 3.0 Cg_exo -30.75 151.1 0.02 OUTLIER 'Trans proline' 0 C--N 1.361 1.21 0 C-N-CA 125.197 3.931 . . . . 0.0 116.395 -164.914 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 74.2 mt -121.2 133.34 68.1 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 CA-C-N 113.939 -1.482 . . . . 0.0 109.784 -172.808 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -79.41 114.37 18.29 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 177.754 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 35.4 m -121.26 177.55 3.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 179.036 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.487 ' HB3' ' HD3' ' A' ' 39' ' ' ARG . 0.9 OUTLIER -138.66 140.36 38.82 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 -178.119 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 12.6 m -115.0 -32.52 5.72 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 112.219 0.451 . . . . 0.0 112.219 -171.823 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.602 ' HG3' ' HG2' ' A' ' 56' ' ' GLN . 14.4 tpt180 -178.97 -39.71 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.694 0.283 . . . . 0.0 111.388 -170.483 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.602 ' HG2' ' HG3' ' A' ' 55' ' ' ARG . 14.5 mm100 -130.25 -47.65 1.09 Allowed 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -169.704 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.6 t -144.19 161.03 39.9 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 120.765 0.317 . . . . 0.0 110.91 -172.601 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.4 m -68.99 146.71 52.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.357 -178.318 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 58.9 tp -131.21 144.88 51.67 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.905 178.579 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -123.99 122.27 37.46 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.846 0.355 . . . . 0.0 110.256 178.895 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.1 pp -122.44 140.15 53.05 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.039 179.67 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.669 ' HD3' ' HD3' ' A' ' 49' ' ' PRO . 19.3 mmt180 -67.12 170.06 7.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.449 0.642 . . . . 0.0 112.193 -175.843 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.4 ptm180 -60.88 -33.6 73.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.226 176.932 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -64.2 -49.29 72.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.625 175.432 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.463 ' OD1' ' HB2' ' A' ' 62' ' ' ARG . 4.3 m-20 -56.46 -40.82 75.48 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-O 121.223 0.535 . . . . 0.0 109.946 177.948 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 61.2 tp -58.42 -43.39 88.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.783 176.164 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -73.27 -12.68 60.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.551 -177.203 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.496 HD22 ' HA ' ' A' ' 19' ' ' ILE . 97.4 mt -96.8 -16.5 20.78 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.788 179.477 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.57 HD21 HD13 ' A' ' 27' ' ' LEU . 96.1 mt -116.15 118.94 34.22 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.894 0.378 . . . . 0.0 110.286 179.678 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.0 m -77.32 114.16 15.85 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.173 0.511 . . . . 0.0 110.049 -179.282 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.564 ' CD2' HG12 ' A' ' 12' ' ' ILE . 96.1 mt -118.59 127.62 53.77 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.453 -176.711 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 28.5 m -129.73 149.15 72.19 Favored Pre-proline 0 C--N 1.319 -0.74 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 174.647 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -65.97 163.39 31.29 Favored 'Trans proline' 0 N--CA 1.46 -0.46 0 C-N-CA 121.621 1.547 . . . . 0.0 111.398 177.668 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 89.3 mt -62.5 -41.87 99.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.164 0.507 . . . . 0.0 109.799 178.67 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 29.3 t70 . . . . . 0 C--O 1.248 0.994 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.476 175.819 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 18.2 m . . . . . 0 N--CA 1.435 -1.189 0 CA-C-O 120.884 0.373 . . . . 0.0 110.813 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.451 ' O ' HG12 ' A' ' 40' ' ' VAL . 35.3 mmt180 -137.26 174.57 10.47 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 121.455 0.645 . . . . 0.0 110.782 -176.948 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.467 ' HB2' ' CD1' ' A' ' 74' ' ' LEU . 51.1 m -113.53 133.44 55.24 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.078 172.079 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.4 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 60.5 m-85 -111.49 127.0 55.56 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -177.456 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.511 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 12.8 ptt180 -98.01 149.25 22.66 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.105 0.479 . . . . 0.0 110.625 -179.443 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.556 HG12 ' CD2' ' A' ' 71' ' ' LEU . 21.8 mt -90.34 118.63 36.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.007 -178.366 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 2.2 p -90.89 -12.24 36.76 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.96 0.41 . . . . 0.0 111.231 178.751 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.442 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 152.69 -164.81 30.84 Favored Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.717 -0.754 . . . . 0.0 111.912 176.657 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 48.0 m-85 -97.67 150.96 20.61 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 177.276 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.478 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 20.6 m -68.21 140.62 93.2 Favored Pre-proline 0 C--N 1.317 -0.828 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 177.088 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.478 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 23.6 Cg_exo -64.41 -0.89 3.27 Favored 'Trans proline' 0 CA--C 1.531 0.337 0 C-N-CA 123.047 2.498 . . . . 0.0 113.39 -175.847 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -105.41 17.24 24.25 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.862 0.363 . . . . 0.0 110.913 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.516 HG13 HD22 ' A' ' 68' ' ' LEU . 11.4 tt -93.73 159.76 2.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.619 -179.505 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 21.8 m -95.92 149.92 21.01 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.627 177.267 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -59.04 -48.7 80.63 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.411 -178.281 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.53 -37.16 91.76 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.959 -0.639 . . . . 0.0 112.421 -179.375 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.511 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 0.1 OUTLIER -72.05 -40.0 68.67 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.546 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 56.5 ttt-85 -57.08 -44.94 83.6 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.216 0.532 . . . . 0.0 110.378 175.886 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -62.62 -43.42 98.84 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.429 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 -61.92 -42.47 99.13 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.309 177.596 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.73 HD22 HD12 ' A' ' 32' ' ' LEU . 78.8 mt -66.27 -44.68 82.89 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.314 -179.246 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 42.5 t80 -60.65 -44.68 96.14 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.211 -179.809 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 54.3 m -67.5 -28.93 68.26 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.499 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 69.5 mtm -82.7 -18.99 38.92 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.744 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 119.17 12.2 7.06 Favored Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 120.156 -1.021 . . . . 0.0 113.546 175.738 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.73 HD12 HD22 ' A' ' 27' ' ' LEU . 94.3 mt -102.75 97.45 7.61 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.67 -0.492 . . . . 0.0 109.67 177.987 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.434 ' H ' HD23 ' A' ' 33' ' ' LEU . 1.9 pt? -131.22 152.13 80.06 Favored Pre-proline 0 N--CA 1.449 -0.502 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.89 -176.214 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.442 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 23.7 Cg_exo -64.11 136.2 50.91 Favored 'Trans proline' 0 N--CA 1.463 -0.289 0 C-N-CA 122.728 2.285 . . . . 0.0 111.723 177.039 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 108.98 -14.46 34.1 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.397 -178.901 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.84 -179.68 7.34 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-O 121.002 0.429 . . . . 0.0 110.094 178.342 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.511 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -150.69 138.76 20.12 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.954 -176.629 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.512 ' HB3' ' HB ' ' A' ' 52' ' ' VAL . 1.3 mm? -109.56 127.1 54.24 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.707 177.106 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 18.6 ttm180 -94.21 114.83 27.01 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 176.835 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.672 ' HA ' HG12 ' A' ' 52' ' ' VAL . 5.7 p -69.77 131.5 34.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.748 0.785 . . . . 0.0 111.858 -169.839 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.0 t -104.13 -36.86 4.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.723 177.882 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.2 ttm180 -168.17 140.09 2.91 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -177.493 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.545 HD11 HG21 ' A' ' 40' ' ' VAL . 4.5 mp -118.72 135.1 60.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 164.618 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.674 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -73.99 142.9 80.12 Favored Pre-proline 0 C--N 1.319 -0.718 0 C-N-CA 120.859 -0.336 . . . . 0.0 111.132 -179.296 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -64.9 -12.96 36.9 Favored 'Trans proline' 0 CA--C 1.529 0.274 0 C-N-CA 123.063 2.509 . . . . 0.0 112.138 177.506 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -59.34 -27.51 65.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.066 177.06 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.28 -75.03 0.24 Allowed Glycine 0 CA--C 1.494 -1.226 0 N-CA-C 110.493 -1.043 . . . . 0.0 110.493 -176.713 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -169.49 119.18 0.58 Allowed Pre-proline 0 N--CA 1.45 -0.473 0 CA-C-O 122.333 1.064 . . . . 0.0 112.712 173.203 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.674 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 55.2 Cg_endo -111.85 179.69 0.04 OUTLIER 'Trans proline' 0 N--CA 1.434 -1.998 1 C-N-CA 125.874 4.383 . . . . 0.0 106.718 136.657 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.868 HG22 HG13 ' A' ' 52' ' ' VAL . 8.4 mt -133.94 105.75 7.64 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.8 0 C-N-CA 118.205 -1.398 . . . . 0.0 110.673 176.792 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.507 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 25.0 tp60 -86.27 113.56 22.36 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 173.589 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.868 HG13 HG22 ' A' ' 50' ' ' ILE . 16.3 m -138.44 166.18 23.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-O 120.547 0.213 . . . . 0.0 111.101 -176.097 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -120.27 122.5 41.02 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 174.63 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.9 m -86.07 -78.96 0.26 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.871 -177.438 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.1 ptt180 -148.24 7.82 0.8 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.196 -179.236 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.3 tp60 -136.38 -64.81 0.59 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.123 0.487 . . . . 0.0 110.519 -172.888 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.1 t -153.22 -178.61 7.07 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 -179.059 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.506 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 26.6 m -78.9 143.03 36.27 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.345 0.593 . . . . 0.0 111.142 -179.158 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.507 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 6.3 mt -131.63 170.65 14.47 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.066 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.512 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -140.62 147.21 39.01 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.821 179.366 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.472 HD21 ' HB ' ' A' ' 50' ' ' ILE . 1.3 pt? -148.92 158.33 44.09 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.865 -0.421 . . . . 0.0 109.865 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 16.1 mmt180 -100.23 173.35 6.65 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.95 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.59 -34.88 65.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.041 -179.522 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 79.2 tttt -61.71 -51.6 67.72 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.852 0.358 . . . . 0.0 110.76 177.533 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.463 ' HB3' ' HB2' ' A' ' 61' ' ' LEU . 3.3 t70 -65.3 -38.66 90.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.501 0.667 . . . . 0.0 109.504 -178.525 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.585 HD22 HD11 ' A' ' 50' ' ' ILE . 59.0 tp -60.42 -39.13 86.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.138 176.19 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.02 -17.26 64.36 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.969 -176.303 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.516 HD22 HG13 ' A' ' 19' ' ' ILE . 86.2 mt -83.45 -25.7 30.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.0 0.429 . . . . 0.0 111.005 179.354 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.702 HD11 HD13 ' A' ' 32' ' ' LEU . 88.9 mt -109.69 131.78 54.74 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.712 -176.496 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.3 m -88.37 113.59 24.12 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 175.814 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.556 ' CD2' HG12 ' A' ' 12' ' ' ILE . 75.4 mt -115.82 132.45 56.64 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.506 -175.363 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.408 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 34.7 m -127.73 141.26 40.5 Favored Pre-proline 0 C--N 1.32 -0.684 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 174.311 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 72' ' ' VAL . 22.8 Cg_exo -64.65 162.29 32.02 Favored 'Trans proline' 0 C--O 1.233 0.257 0 C-N-CA 121.74 1.627 . . . . 0.0 112.343 179.392 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.467 ' CD1' ' HB2' ' A' ' 9' ' ' SER . 75.2 mt -70.31 -45.49 66.15 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.511 173.649 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 32.9 t70 . . . . . 0 C--O 1.244 0.801 0 CA-C-O 118.228 -0.892 . . . . 0.0 109.764 179.015 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 75.4 m . . . . . 0 N--CA 1.434 -1.236 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.404 ' H ' HG12 ' A' ' 40' ' ' VAL . 11.2 mpt_? -101.05 153.41 19.58 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.206 0.527 . . . . 0.0 111.506 -170.639 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.59 ' HA ' ' HA ' ' A' ' 39' ' ' ARG . 30.8 m -104.99 131.86 51.96 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.519 177.354 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.409 ' HE2' ' HB ' ' A' ' 40' ' ' VAL . 43.5 m-85 -115.21 132.33 56.64 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 -179.564 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.477 ' HG3' HG23 ' A' ' 72' ' ' VAL . 25.5 ptt180 -99.54 145.97 26.91 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.066 0.46 . . . . 0.0 110.994 -177.706 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.574 HG12 ' CD2' ' A' ' 71' ' ' LEU . 18.0 mt -93.53 119.26 41.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.281 -177.455 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 7.4 p -92.83 -19.06 22.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.8 0.333 . . . . 0.0 111.577 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.42 ' HA2' ' HB3' ' A' ' 34' ' ' PRO . . . 164.82 -151.84 21.09 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.099 179.301 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -115.58 152.84 32.3 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.882 0.372 . . . . 0.0 110.281 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.53 ' O ' HG22 ' A' ' 19' ' ' ILE . 49.2 m -78.83 150.76 75.87 Favored Pre-proline 0 N--CA 1.442 -0.846 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.497 179.433 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -70.48 11.25 0.49 Allowed 'Trans proline' 0 N--CA 1.474 0.379 0 C-N-CA 123.161 2.574 . . . . 0.0 113.598 -176.061 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -106.23 1.82 26.35 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.757 0.313 . . . . 0.0 111.04 179.02 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.53 HG22 ' O ' ' A' ' 16' ' ' SER . 16.4 tt -89.28 143.18 11.71 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 CA-C-O 120.942 0.401 . . . . 0.0 110.735 -179.053 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 21.2 t -156.41 -174.87 5.14 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 -178.054 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 61.37 -155.88 0.35 Allowed 'General case' 0 CA--C 1.537 0.472 0 O-C-N 123.467 0.48 . . . . 0.0 109.768 179.5 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -90.17 23.64 20.19 Favored Glycine 0 CA--C 1.519 0.289 0 C-N-CA 120.896 -0.668 . . . . 0.0 112.034 178.484 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.469 ' CE1' HD12 ' A' ' 68' ' ' LEU . 6.3 t80 -68.45 -38.0 80.72 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.865 0.365 . . . . 0.0 110.486 -176.612 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 15.5 ttm180 -64.62 -38.96 92.8 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.804 178.994 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -69.72 -32.22 70.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.733 179.115 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.3 tpp180 -65.59 -44.16 87.48 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 175.383 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.456 HD22 HD12 ' A' ' 32' ' ' LEU . 89.2 mt -66.84 -41.97 86.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.472 179.498 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -56.29 -44.76 80.17 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.274 177.586 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 50.8 m -61.6 -33.35 73.75 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.25 178.105 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 85.1 mtp -82.52 -11.76 58.24 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.37 -179.133 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 94.61 11.16 57.27 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.835 -0.697 . . . . 0.0 111.946 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.456 HD12 HD22 ' A' ' 27' ' ' LEU . 86.7 mt -92.2 90.08 7.16 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.278 0.561 . . . . 0.0 109.787 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.3 pp -145.32 161.05 43.36 Favored Pre-proline 0 C--N 1.321 -0.674 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.773 -175.955 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.42 ' HB3' ' HA2' ' A' ' 14' ' ' GLY . 14.7 Cg_endo -58.03 128.15 27.74 Favored 'Trans proline' 0 C--O 1.235 0.351 0 C-N-CA 122.861 2.374 . . . . 0.0 112.011 177.192 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 111.96 -14.19 26.5 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.953 -0.642 . . . . 0.0 111.631 -176.75 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.528 ' HB3' HD12 ' A' ' 12' ' ' ILE . . . -93.13 -179.86 5.21 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-O 121.114 0.483 . . . . 0.0 110.16 178.587 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -154.97 146.5 23.14 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.694 -177.723 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 57.1 mt -130.89 132.77 45.35 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.805 177.85 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.59 ' HA ' ' HA ' ' A' ' 9' ' ' SER . 79.5 ttt180 -100.06 127.44 46.29 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.304 -0.407 . . . . 0.0 109.953 178.687 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.458 ' HA ' HG12 ' A' ' 52' ' ' VAL . 5.1 p -66.53 120.84 14.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 121.254 0.549 . . . . 0.0 109.967 -179.37 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.822 ' HB ' ' HG2' ' A' ' 51' ' ' GLN . 43.0 t -92.62 -59.43 3.01 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.922 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.547 173.165 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 56.0 mtm180 -156.23 160.38 39.76 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.202 0.525 . . . . 0.0 112.099 -179.02 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 80.4 mt -129.62 135.11 62.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 172.345 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.543 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -71.84 153.79 92.97 Favored Pre-proline 0 C--N 1.327 -0.389 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -176.284 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 25.9 Cg_exo -63.61 -17.65 60.89 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 123.678 2.919 . . . . 0.0 113.499 -179.144 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 7.1 tt -46.99 -50.4 19.21 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.958 0.885 . . . . 0.0 109.985 175.374 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.92 -46.39 0.57 Allowed Glycine 0 N--CA 1.432 -1.624 0 N-CA-C 109.799 -1.321 . . . . 0.0 109.799 -172.546 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -174.42 117.36 0.34 Allowed Pre-proline 0 N--CA 1.449 -0.479 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 174.167 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.543 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 69.4 Cg_endo -115.65 -172.87 0.02 OUTLIER 'Trans proline' 0 N--CA 1.438 -1.753 1 C-N-CA 126.969 5.112 . . . . 0.0 106.637 132.43 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.734 HG22 HG13 ' A' ' 52' ' ' VAL . 50.8 mt -140.81 117.15 7.55 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.446 0 C-N-CA 118.866 -1.134 . . . . 0.0 111.24 175.898 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.822 ' HG2' ' HB ' ' A' ' 41' ' ' VAL . 32.4 tt0 -96.55 118.32 32.79 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.051 -0.977 . . . . 0.0 108.492 174.963 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.734 HG13 HG22 ' A' ' 50' ' ' ILE . 15.4 m -135.81 165.9 28.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.393 0.616 . . . . 0.0 112.212 -176.803 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -112.91 126.14 55.14 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.06 175.527 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.4 t -82.85 -28.33 30.18 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.04 178.588 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.49 -43.42 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 114.982 -1.008 . . . . 0.0 108.644 177.471 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -130.21 -37.1 1.47 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.705 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.7 t -106.83 158.76 16.75 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.738 -177.549 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.431 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 15.3 m -101.82 157.53 16.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.67 -177.26 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.52 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 8.7 mt -135.71 163.82 29.29 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.061 0.458 . . . . 0.0 111.465 179.121 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.569 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -140.73 135.51 31.63 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.333 175.098 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -159.49 178.65 9.67 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 -175.48 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.447 ' HD3' ' HA ' ' A' ' 62' ' ' ARG . 9.8 mmt85 -109.43 169.1 8.92 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.7 0.762 . . . . 0.0 112.299 179.516 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.1 ptp180 -60.81 -37.55 82.39 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.181 -1.372 . . . . 0.0 112.328 -174.501 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -59.81 -46.56 88.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.164 0.507 . . . . 0.0 110.678 178.939 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -66.48 -37.08 84.31 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.159 -176.29 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.573 HD22 ' CD1' ' A' ' 50' ' ' ILE . 4.6 tp -71.4 -38.71 71.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.692 176.846 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.07 -21.94 65.86 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.727 -0.669 . . . . 0.0 112.121 -175.082 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.469 HD12 ' CE1' ' A' ' 23' ' ' TYR . 60.5 mt -79.2 -12.71 59.97 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.456 -0.497 . . . . 0.0 110.555 177.144 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.403 HD11 HD13 ' A' ' 32' ' ' LEU . 82.2 mt -97.09 138.03 35.23 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 171.85 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 17.7 m -88.4 113.87 24.44 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 173.39 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.574 ' CD2' HG12 ' A' ' 12' ' ' ILE . 77.3 mt -116.86 134.1 55.19 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.907 -175.28 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.477 HG23 ' HG3' ' A' ' 11' ' ' ARG . 29.4 m -125.51 138.92 32.77 Favored Pre-proline 0 C--N 1.317 -0.825 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 172.026 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -65.04 165.02 22.89 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 121.669 1.579 . . . . 0.0 111.286 177.959 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 9' ' ' SER . 89.6 mt -51.9 -31.59 29.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.525 174.815 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 38.2 t70 . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.524 -0.751 . . . . 0.0 110.654 178.655 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.527 ' O ' ' HG3' ' A' ' 8' ' ' ARG . 36.5 t . . . . . 0 N--CA 1.452 -0.365 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.527 ' HG3' ' O ' ' A' ' 7' ' ' SER . 39.1 mtp85 -155.36 153.12 29.98 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 179.758 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.501 ' HB2' ' CD1' ' A' ' 74' ' ' LEU . 52.1 m -63.24 146.1 54.12 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.252 0.549 . . . . 0.0 111.058 -177.255 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -117.27 125.2 50.72 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.996 -177.623 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.553 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 26.2 ptt180 -95.01 154.18 17.29 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.069 0.461 . . . . 0.0 110.716 -178.217 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.502 HG12 ' CD2' ' A' ' 71' ' ' LEU . 18.4 mt -94.89 119.45 42.94 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.117 -177.999 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 4.5 p -94.46 -17.86 22.06 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.637 0.256 . . . . 0.0 111.254 179.012 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 1.001 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 161.32 -161.12 32.8 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.44 -0.886 . . . . 0.0 112.283 177.805 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 65.8 m-85 -110.47 156.39 20.92 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.605 -0.516 . . . . 0.0 109.605 177.808 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.482 ' O ' HG22 ' A' ' 19' ' ' ILE . 49.1 m -72.77 132.17 83.45 Favored Pre-proline 0 N--CA 1.442 -0.838 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 174.376 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -63.82 2.53 0.99 Allowed 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 123.325 2.683 . . . . 0.0 113.746 -174.67 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.01 -9.31 37.26 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.018 177.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.707 HD12 ' HB3' ' A' ' 68' ' ' LEU . 11.8 tt -84.49 143.54 11.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.107 0.48 . . . . 0.0 110.784 -178.247 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 41.2 m -84.12 158.24 21.45 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.354 177.355 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -63.74 -37.5 87.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.537 -173.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.47 ' O ' ' HB2' ' A' ' 25' ' ' GLN . . . -64.08 -41.27 98.55 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.679 -178.052 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -75.51 -32.87 60.67 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 178.427 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 40.3 ttt-85 -58.58 -35.39 72.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.437 172.469 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.47 ' HB2' ' O ' ' A' ' 22' ' ' GLY . 84.1 mt-30 -65.12 -33.5 76.17 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.621 177.231 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.6 tmm_? -66.01 -41.32 91.14 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.089 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 96.2 mt -69.1 -44.67 71.99 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.447 178.386 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -59.4 -43.94 92.91 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.83 179.548 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.4 m -63.59 -32.95 74.57 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.935 178.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 77.5 mtp -77.5 -15.82 59.08 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.094 178.724 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 95.29 15.87 42.68 Favored Glycine 0 N--CA 1.446 -0.681 0 C-N-CA 120.877 -0.678 . . . . 0.0 111.93 178.612 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.432 HD13 HD11 ' A' ' 69' ' ' LEU . 90.8 mt -92.69 79.44 4.79 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.62 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.6 pp -132.97 162.08 59.79 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.98 -173.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 1.001 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 35.2 Cg_exo -58.46 122.07 11.04 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.785 2.323 . . . . 0.0 112.119 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.46 -17.05 9.69 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.344 -179.53 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -94.6 -176.11 3.81 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 177.575 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -157.34 138.95 13.97 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.957 -177.633 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.425 ' N ' HD22 ' A' ' 38' ' ' LEU . 2.5 mm? -99.65 135.8 40.53 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 176.142 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.455 HH11 ' HD2' ' A' ' 39' ' ' ARG . 21.8 ttt180 -96.18 111.24 23.35 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.834 -178.423 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 7.8 p -60.48 127.08 19.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.438 0.637 . . . . 0.0 111.495 -177.424 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 49.6 t -103.55 -55.2 5.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.472 173.136 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 48.4 mtm180 -152.33 168.09 26.54 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.87 179.47 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.418 HG13 HG23 ' A' ' 50' ' ' ILE . 4.7 mp -124.49 139.37 50.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 174.049 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.469 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -68.82 135.29 89.99 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 120.633 0.254 . . . . 0.0 110.461 178.866 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.469 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 23.9 Cg_exo -65.74 -1.57 5.18 Favored 'Trans proline' 0 N--CA 1.475 0.419 0 C-N-CA 123.117 2.545 . . . . 0.0 113.195 -178.315 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -94.38 -16.94 23.03 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.812 179.515 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.48 ' O ' ' HD2' ' A' ' 63' ' ' ARG . . . 91.88 -9.53 76.5 Favored Glycine 0 N--CA 1.454 -0.15 0 N-CA-C 110.417 -1.073 . . . . 0.0 110.417 -171.178 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.878 ' HB3' ' HD2' ' A' ' 49' ' ' PRO . 6.5 m-20 -74.2 171.55 10.88 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 114.022 -1.089 . . . . 0.0 110.285 174.895 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.878 ' HD2' ' HB3' ' A' ' 48' ' ' ASP . 14.4 Cg_exo -24.43 152.13 0.0 OUTLIER 'Trans proline' 0 C--N 1.362 1.289 1 C-N-CA 126.316 4.678 . . . . 0.0 117.291 -167.665 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.509 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 71.0 mt -109.89 138.3 38.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-N 113.638 -1.619 . . . . 0.0 109.602 -171.345 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -86.72 108.92 18.89 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 35.8 m -121.18 -179.43 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.488 ' HA ' ' HA ' ' A' ' 58' ' ' SER . 34.0 tt0 -136.87 134.36 36.79 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 179.648 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.0 p -84.07 -45.86 12.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.325 0.583 . . . . 0.0 110.317 -177.105 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 28.8 ttm180 -161.8 -59.19 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.331 -0.849 . . . . 0.0 108.98 177.038 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -111.3 -39.27 4.75 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.308 177.914 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.8 t -103.06 149.87 24.15 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.912 0.387 . . . . 0.0 111.135 -172.894 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.488 ' HA ' ' HA ' ' A' ' 53' ' ' GLU . 21.3 m -95.17 152.09 18.65 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.576 179.751 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 53.1 tp -143.17 146.82 34.05 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.897 -177.564 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.509 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -112.28 124.82 53.3 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.95 176.658 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.66 HD13 HD13 ' A' ' 66' ' ' LEU . 1.3 pp -109.66 125.63 52.82 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.066 0.46 . . . . 0.0 110.584 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.438 ' HG3' ' HG3' ' A' ' 49' ' ' PRO . 2.9 mpt_? -67.24 171.98 5.24 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.068 -177.743 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.48 ' HD2' ' O ' ' A' ' 47' ' ' GLY . 0.0 OUTLIER -67.27 -44.52 79.13 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.589 179.445 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 60.0 tttp -70.71 -40.37 72.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.972 0.415 . . . . 0.0 110.324 177.624 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -63.75 -35.23 79.88 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.967 178.386 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.66 HD13 HD13 ' A' ' 61' ' ' LEU . 40.7 tp -68.81 -38.13 79.71 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.561 174.468 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.01 -15.43 63.02 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.903 -176.494 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.707 ' HB3' HD12 ' A' ' 19' ' ' ILE . 72.0 mt -83.87 -24.75 30.73 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.011 0.434 . . . . 0.0 110.751 177.985 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.432 HD11 HD13 ' A' ' 32' ' ' LEU . 87.8 mt -102.81 141.77 35.06 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.446 179.652 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.1 m -96.42 113.42 25.0 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 170.547 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.502 ' CD2' HG12 ' A' ' 12' ' ' ILE . 51.7 mt -121.19 137.1 54.83 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.628 -176.263 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 34.6 m -132.36 150.24 75.37 Favored Pre-proline 0 C--N 1.321 -0.653 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 174.053 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -60.21 163.75 13.95 Favored 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 121.863 1.708 . . . . 0.0 111.716 177.311 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.501 ' CD1' ' HB2' ' A' ' 9' ' ' SER . 74.8 mt -66.22 -12.17 54.48 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.022 175.861 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.3 t70 . . . . . 0 C--O 1.249 1.033 0 O-C-N 124.285 0.991 . . . . 0.0 110.311 -178.095 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 ptm . . . . . 0 N--CA 1.478 0.934 0 CA-C-O 120.573 0.225 . . . . 0.0 110.493 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.8 m -116.43 81.2 1.58 Allowed 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 175.201 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 65.24 176.84 0.2 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.253 -170.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.876 ' HB3' HG13 ' A' ' 41' ' ' VAL . 61.1 tp -146.12 99.02 3.19 Favored 'General case' 0 C--N 1.322 -0.618 0 O-C-N 122.229 -0.294 . . . . 0.0 110.567 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 53.21 72.27 1.2 Allowed Pre-proline 0 CA--C 1.531 0.238 0 O-C-N 124.037 0.835 . . . . 0.0 111.288 178.403 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -75.41 117.27 4.76 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 122.361 2.04 . . . . 0.0 112.074 -177.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 35.3 t -94.13 -48.77 6.06 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.87 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.464 ' O ' HG12 ' A' ' 40' ' ' VAL . 54.0 mtt180 -145.72 159.65 42.86 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.425 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.418 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 69.4 m -120.82 133.92 55.3 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.717 173.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.554 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 56.6 m-85 -114.35 129.21 56.64 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.666 -177.52 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.561 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 85.0 mtt180 -92.38 157.9 16.36 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.0 0.429 . . . . 0.0 110.692 178.814 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 51.8 mt -95.74 104.79 16.23 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 173.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.579 ' HB ' HG22 ' A' ' 72' ' ' VAL . 2.9 t -81.94 -14.61 55.86 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.128 0.49 . . . . 0.0 110.444 -175.631 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.731 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 157.93 -163.68 32.86 Favored Glycine 0 N--CA 1.442 -0.956 0 C-N-CA 120.886 -0.674 . . . . 0.0 112.038 179.308 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -97.71 153.38 18.28 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 88.7 p -74.38 162.17 74.95 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.869 -179.619 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_exo -71.39 -12.64 29.88 Favored 'Trans proline' 0 CA--C 1.529 0.229 0 C-N-CA 122.58 2.186 . . . . 0.0 112.095 174.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -89.12 -0.99 57.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.742 -178.128 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.455 HD11 ' CA ' ' A' ' 24' ' ' ARG . 18.6 tt -65.6 124.92 21.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.984 0.421 . . . . 0.0 110.017 179.597 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.5 m -138.77 159.35 42.34 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.848 -0.341 . . . . 0.0 111.876 -172.686 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 64.1 t30 60.46 41.19 16.22 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 115.549 -0.75 . . . . 0.0 112.687 168.487 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 70.19 21.97 77.28 Favored Glycine 0 C--N 1.331 0.261 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.988 174.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.516 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -65.88 -23.18 66.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.729 0.265 . . . . 0.0 111.294 179.823 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.455 ' CA ' HD11 ' A' ' 19' ' ' ILE . 6.0 ttm-85 -59.61 -36.3 76.05 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 121.342 0.592 . . . . 0.0 109.507 176.828 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -69.24 -36.42 77.16 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.781 179.619 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 25.2 tpp180 -67.01 -42.22 85.33 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 176.22 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 23' ' ' TYR . 84.1 mt -66.15 -43.13 87.87 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.232 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -61.55 -41.36 97.24 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.175 0.512 . . . . 0.0 110.242 178.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 63.3 m -60.47 -35.69 76.5 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.801 175.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 71.4 mtm -84.29 -11.52 56.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.613 -178.002 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 93.55 27.72 12.56 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.911 -0.662 . . . . 0.0 112.662 177.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.61 HD13 HD11 ' A' ' 69' ' ' LEU . 94.5 mt -105.74 102.77 12.2 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.083 0.468 . . . . 0.0 110.573 178.852 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.413 ' N ' HD23 ' A' ' 33' ' ' LEU . 1.8 pt? -138.02 157.11 73.63 Favored Pre-proline 0 N--CA 1.448 -0.574 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.225 -179.35 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.731 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 28.6 Cg_exo -62.13 136.8 62.6 Favored 'Trans proline' 0 C--O 1.233 0.275 0 C-N-CA 122.573 2.182 . . . . 0.0 111.92 178.05 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 114.69 -17.74 17.85 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.323 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -86.03 175.99 8.27 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-O 121.046 0.451 . . . . 0.0 110.215 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.561 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -148.56 148.18 29.88 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.045 -177.151 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 49.0 mt -122.7 130.24 52.72 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.084 178.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 14.5 ttm180 -98.13 119.6 37.07 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.41 178.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.491 ' HA ' HG12 ' A' ' 52' ' ' VAL . 13.4 p -61.3 127.3 20.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -171.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.876 HG13 ' HB3' ' A' ' 4' ' ' LEU . 76.1 t -98.0 -54.66 6.75 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 165.816 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.439 ' HB3' ' O ' ' A' ' 41' ' ' VAL . 15.9 ptt180 173.3 156.14 0.11 Allowed 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.359 0.6 . . . . 0.0 111.944 174.67 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.401 HG23 ' O ' ' A' ' 49' ' ' PRO . 84.4 mt -118.15 142.27 33.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 170.08 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.67 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -74.81 134.04 75.67 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-O 120.501 0.191 . . . . 0.0 110.556 176.806 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -66.8 -19.86 52.66 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 123.233 2.622 . . . . 0.0 112.999 -174.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 46' ' ' LEU . 4.0 mm? -51.48 -44.85 62.58 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.567 0.699 . . . . 0.0 110.509 176.541 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -174.97 -74.16 0.05 OUTLIER Glycine 0 N--CA 1.431 -1.651 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.328 -177.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.508 ' OD1' ' HD3' ' A' ' 63' ' ' ARG . 6.8 p-10 -177.97 127.16 0.28 Allowed Pre-proline 0 N--CA 1.442 -0.858 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 -179.088 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.67 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 73.5 Cg_endo -114.28 -168.2 0.02 OUTLIER 'Trans proline' 0 N--CA 1.43 -2.236 0 C-N-CA 124.482 3.455 . . . . 0.0 106.569 129.295 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.743 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 58.6 mt -145.1 99.9 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.35 0 C-N-CA 119.93 -0.708 . . . . 0.0 109.432 170.781 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.417 ' HA ' ' OE1' ' A' ' 51' ' ' GLN . 14.2 mm-40 -86.41 121.45 28.98 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 174.456 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.491 HG12 ' HA ' ' A' ' 40' ' ' VAL . 9.5 m -142.22 172.76 8.48 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.927 -179.047 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -122.22 150.82 41.75 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 177.078 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 29.3 p -120.11 -30.46 4.66 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -173.722 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 27.2 tpt180 178.61 -54.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.864 -175.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -143.82 4.79 1.32 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.568 -179.19 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.9 t -149.93 138.73 20.91 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.234 0.54 . . . . 0.0 111.063 -175.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.1 p -80.22 148.78 30.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.402 -178.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.582 HD13 ' N ' ' A' ' 60' ' ' ALA . 2.4 tm? -129.56 148.73 51.49 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.22 -0.445 . . . . 0.0 109.906 -178.366 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.743 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -139.72 148.11 41.85 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.969 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.585 HD11 HD12 ' A' ' 50' ' ' ILE . 3.9 pp -162.98 -179.18 6.56 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.543 -0.539 . . . . 0.0 109.543 -179.066 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 26.0 mmm-85 -110.83 170.06 8.35 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 122.03 0.919 . . . . 0.0 112.286 -177.338 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.508 ' HD3' ' OD1' ' A' ' 48' ' ' ASP . 18.1 ptt-85 -62.98 -35.17 79.28 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 113.771 -1.559 . . . . 0.0 111.455 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -71.52 -33.95 69.64 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.015 -178.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -75.31 -36.73 61.07 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.389 0.614 . . . . 0.0 109.536 176.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.622 HD11 HD11 ' A' ' 71' ' ' LEU . 37.6 tp -64.38 -30.39 71.43 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.737 175.028 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.09 -9.77 48.76 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.591 -178.511 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.482 ' HB3' HD11 ' A' ' 27' ' ' LEU . 63.6 mt -91.79 -5.38 53.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.041 0.448 . . . . 0.0 110.568 175.824 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.61 HD11 HD13 ' A' ' 32' ' ' LEU . 95.8 mt -119.83 153.75 35.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.952 -178.613 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 15.8 m -113.3 121.22 43.76 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.02 -0.537 . . . . 0.0 109.577 170.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.622 HD11 HD11 ' A' ' 66' ' ' LEU . 64.8 mt -103.46 146.37 28.62 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.263 0.554 . . . . 0.0 111.578 -175.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.579 HG22 ' HB ' ' A' ' 13' ' ' THR . 12.3 m -129.49 117.86 18.82 Favored Pre-proline 0 C--N 1.322 -0.63 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.669 173.442 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.554 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 7.9 Cg_exo -70.95 163.02 40.67 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 121.995 1.796 . . . . 0.0 111.728 -178.416 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 9' ' ' SER . 86.7 mt -58.33 -47.95 82.1 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 172.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 . . . . . 0 C--O 1.25 1.116 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.72 174.685 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.4 ptt? . . . . . 0 N--CA 1.481 1.124 0 CA-C-O 121.282 0.563 . . . . 0.0 110.682 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.8 m -159.71 -56.3 0.06 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.204 178.266 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 48.52 90.18 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.306 0 O-C-N 124.382 1.051 . . . . 0.0 113.173 175.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.402 HD13 ' HA ' ' A' ' 4' ' ' LEU . 3.7 mm? -70.84 -24.52 62.54 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 174.473 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 72.57 148.98 0.12 Allowed Pre-proline 0 N--CA 1.468 0.457 0 CA-C-N 115.106 -0.952 . . . . 0.0 112.144 176.473 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.51 ' HB3' ' O ' ' A' ' 40' ' ' VAL . 27.2 Cg_endo -63.84 110.06 1.22 Allowed 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.965 2.443 . . . . 0.0 112.059 177.357 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.516 ' HB3' ' HD3' ' A' ' 8' ' ' ARG . 22.9 t -99.23 -49.81 4.35 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.183 178.935 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.516 ' HD3' ' HB3' ' A' ' 7' ' ' SER . 0.0 OUTLIER -143.82 157.09 44.61 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.282 -179.864 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.424 ' HB2' ' CD1' ' A' ' 74' ' ' LEU . 15.3 m -105.1 164.13 12.04 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 176.021 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -127.87 132.84 49.33 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.865 -0.334 . . . . 0.0 110.989 -176.424 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.479 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 17.1 mtp180 -91.1 152.23 20.7 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.18 -0.464 . . . . 0.0 109.771 175.093 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.547 HG12 ' CD2' ' A' ' 71' ' ' LEU . 33.5 mt -102.9 117.62 48.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 176.495 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 2.9 p -87.34 -24.47 24.26 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.11 0.481 . . . . 0.0 110.74 177.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 165.62 -154.19 24.71 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.822 -0.704 . . . . 0.0 111.752 -179.185 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.473 ' CE1' ' HG3' ' A' ' 24' ' ' ARG . 44.9 m-85 -113.82 152.97 29.9 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 -177.016 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.435 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 20.9 m -70.35 140.21 87.47 Favored Pre-proline 0 C--N 1.319 -0.741 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.395 177.72 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 34.8 Cg_exo -61.57 -20.51 69.02 Favored 'Trans proline' 0 CA--C 1.529 0.265 0 C-N-CA 122.874 2.382 . . . . 0.0 112.22 179.524 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.68 29.24 2.37 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.933 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.521 HG13 HD22 ' A' ' 68' ' ' LEU . 19.8 tt -74.58 149.72 7.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.534 179.003 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.489 ' O ' ' HB2' ' A' ' 23' ' ' TYR . 9.3 m -89.43 117.94 28.72 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -173.153 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 24.47 88.15 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 115.407 1.632 . . . . 0.0 115.407 165.615 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.66 9.13 55.05 Favored Glycine 0 CA--C 1.517 0.176 0 N-CA-C 114.797 0.679 . . . . 0.0 114.797 171.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.489 ' HB2' ' O ' ' A' ' 20' ' ' SER . 0.9 OUTLIER -64.97 -23.06 67.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 117.75 0.775 . . . . 0.0 111.37 179.785 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.473 ' HG3' ' CE1' ' A' ' 15' ' ' TYR . 34.2 ttm180 -56.02 -46.58 78.75 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 121.165 0.507 . . . . 0.0 110.0 174.083 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -65.04 -34.48 78.54 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.996 -178.21 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 33.9 ttm180 -73.16 -39.85 65.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.157 178.258 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.515 HD22 HD12 ' A' ' 32' ' ' LEU . 95.3 mt -68.68 -43.57 75.84 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.26 -178.746 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -60.89 -42.44 97.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.248 179.423 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 69.9 m -67.4 -31.05 71.01 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.22 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.425 ' CE ' HD23 ' A' ' 27' ' ' LEU . 68.0 mtm -79.16 -27.67 42.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.233 179.72 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 124.48 4.51 7.52 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.32 -0.943 . . . . 0.0 112.857 177.849 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.543 HD13 HD11 ' A' ' 69' ' ' LEU . 92.1 mt -97.15 93.73 6.73 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 pp -139.05 159.05 68.38 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.615 -173.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.25 121.56 10.12 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.787 2.325 . . . . 0.0 112.08 177.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 114.74 -19.92 15.58 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 121.055 -0.593 . . . . 0.0 111.797 -176.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.492 ' O ' HG13 ' A' ' 12' ' ' ILE . . . -83.81 106.9 15.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.227 0.537 . . . . 0.0 110.46 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.479 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -88.58 116.33 26.75 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.772 177.33 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.49 HD13 HG21 ' A' ' 52' ' ' VAL . 70.5 mt -94.59 134.15 37.45 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.311 0.577 . . . . 0.0 110.236 -177.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 49.5 ttt180 -98.25 115.1 27.67 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.728 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.555 ' HA ' HG12 ' A' ' 52' ' ' VAL . 99.4 t -64.03 120.43 10.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 123.402 0.439 . . . . 0.0 111.275 -178.519 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.682 HG12 ' HG3' ' A' ' 42' ' ' ARG . 53.1 t -98.14 -53.56 7.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.52 174.171 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.682 ' HG3' HG12 ' A' ' 41' ' ' VAL . 25.7 mtp180 -148.46 140.12 23.66 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -173.279 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.2 mp -120.14 141.11 41.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 168.29 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.811 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -79.39 134.5 58.45 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-O 120.566 0.222 . . . . 0.0 110.868 176.347 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -64.64 -7.56 14.95 Favored 'Trans proline' 0 N--CA 1.479 0.636 0 C-N-CA 123.384 2.723 . . . . 0.0 113.159 -177.382 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.15 -37.93 81.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.593 0.711 . . . . 0.0 110.891 175.724 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.449 ' O ' ' HB2' ' A' ' 48' ' ' ASP . . . 174.3 -76.42 0.08 OUTLIER Glycine 0 N--CA 1.436 -1.332 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 -175.517 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.449 ' HB2' ' O ' ' A' ' 47' ' ' GLY . 17.2 t70 -179.58 118.37 0.22 Allowed Pre-proline 0 N--CA 1.453 -0.306 0 N-CA-C 113.658 0.985 . . . . 0.0 113.658 173.131 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.811 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 30.7 Cg_endo -111.49 160.77 0.05 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.441 1 C-N-CA 126.049 4.499 . . . . 0.0 108.835 139.309 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.667 HG22 HG13 ' A' ' 52' ' ' VAL . 2.7 mp -119.64 106.09 18.51 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.69 0 C-N-CA 118.89 -1.124 . . . . 0.0 110.028 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.535 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 0.8 OUTLIER -86.5 111.8 20.92 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 174.436 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.667 HG13 HG22 ' A' ' 50' ' ' ILE . 21.4 m -124.01 173.15 10.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.305 0.574 . . . . 0.0 111.922 -174.181 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -120.02 128.27 53.38 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.912 179.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.5 m -86.16 -40.01 16.08 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 173.353 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 26.2 ttp85 -179.63 -49.88 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.781 -1.099 . . . . 0.0 108.537 173.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -128.63 -24.22 3.04 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.095 174.209 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.8 t -93.12 138.95 31.08 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 121.131 0.491 . . . . 0.0 109.679 177.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 21.7 m -109.35 137.18 47.6 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.672 178.256 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.535 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 12.1 mt -123.84 152.13 42.64 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.98 -177.193 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.411 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -129.98 118.61 21.89 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 114.946 -1.025 . . . . 0.0 109.16 177.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.494 ' HB2' ' HB2' ' A' ' 65' ' ' ASP . 0.7 OUTLIER -124.26 150.05 45.78 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -174.74 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.574 ' N ' ' HD3' ' A' ' 62' ' ' ARG . 0.8 OUTLIER -97.89 176.43 5.79 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 120.953 0.406 . . . . 0.0 110.436 -176.154 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -54.01 -34.42 59.85 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.086 175.079 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.1 -45.72 90.14 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.981 177.382 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.494 ' HB2' ' HB2' ' A' ' 61' ' ' LEU . 5.1 m-20 -67.34 -41.68 84.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.064 178.698 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 62.1 tp -59.07 -37.82 77.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.822 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.97 -25.01 66.91 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.55 -178.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.521 HD22 HG13 ' A' ' 19' ' ' ILE . 81.8 mt -88.97 -15.83 33.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.236 -176.367 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.543 HD11 HD13 ' A' ' 32' ' ' LEU . 96.3 mt -110.33 143.2 40.91 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.965 0.412 . . . . 0.0 111.258 -175.699 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 20.4 m -101.57 114.1 27.84 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 172.496 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.547 ' CD2' HG12 ' A' ' 12' ' ' ILE . 75.0 mt -111.4 143.8 41.63 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.212 -174.517 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.497 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 16.3 m -126.37 123.77 24.24 Favored Pre-proline 0 C--N 1.317 -0.818 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.215 173.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.497 ' HD3' ' HA ' ' A' ' 72' ' ' VAL . 13.5 Cg_exo -70.01 161.48 45.82 Favored 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 122.201 1.934 . . . . 0.0 112.427 -175.407 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.424 ' CD1' ' HB2' ' A' ' 9' ' ' SER . 66.9 mt -74.89 -38.88 61.76 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.007 171.539 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.2 t70 . . . . . 0 C--O 1.25 1.096 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.211 -178.821 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.1 tmm? . . . . . 0 N--CA 1.477 0.888 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.9 m -109.31 129.27 55.52 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.346 179.032 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -83.05 80.42 9.05 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.181 0.515 . . . . 0.0 110.147 178.434 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.3 tt -101.61 117.84 35.73 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.474 -175.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -151.33 98.62 3.07 Favored Pre-proline 0 C--N 1.322 -0.628 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 174.499 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.538 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 68.0 Cg_endo -74.26 161.25 40.91 Favored 'Trans proline' 0 N--CA 1.462 -0.372 0 C-N-CA 122.908 2.405 . . . . 0.0 113.216 -172.481 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 31.8 t -122.36 -74.71 0.61 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.496 178.281 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.451 ' H ' HG12 ' A' ' 40' ' ' VAL . 47.1 mtp180 -128.64 167.68 16.84 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 120.816 0.341 . . . . 0.0 110.91 -178.776 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.52 ' HB2' HD12 ' A' ' 74' ' ' LEU . 21.7 m -121.93 142.89 49.82 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.058 0.456 . . . . 0.0 111.621 -173.871 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.46 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 73.2 m-85 -123.11 135.71 54.49 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.001 179.222 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.512 ' HG3' HG23 ' A' ' 72' ' ' VAL . 34.5 ptt180 -107.06 154.24 21.42 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.071 0.462 . . . . 0.0 110.48 179.369 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.444 HG12 ' CD2' ' A' ' 71' ' ' LEU . 26.6 mt -99.21 114.54 37.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.624 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 12.3 t -89.51 -18.44 26.66 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.755 0.312 . . . . 0.0 110.91 -177.1 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.575 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 167.39 -168.24 40.39 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.855 -0.688 . . . . 0.0 111.569 179.775 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -102.02 155.8 17.95 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.969 0.384 . . . . 0.0 110.315 177.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.502 ' O ' HG22 ' A' ' 19' ' ' ILE . 23.5 m -76.68 145.01 74.25 Favored Pre-proline 0 N--CA 1.442 -0.854 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.598 175.169 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 26.6 Cg_exo -62.91 0.39 1.61 Allowed 'Trans proline' 0 N--CA 1.477 0.512 0 C-N-CA 123.21 2.607 . . . . 0.0 114.088 -173.804 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.94 3.63 54.74 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.764 0.316 . . . . 0.0 111.151 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.502 HG22 ' O ' ' A' ' 16' ' ' SER . 15.4 tt -84.63 124.59 39.98 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-O 121.371 0.605 . . . . 0.0 110.793 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.2 m -156.12 -176.08 5.77 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.985 -177.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 66.2 t30 64.01 29.27 14.34 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 122.949 0.5 . . . . 0.0 112.06 170.498 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 81.8 5.56 89.72 Favored Glycine 0 N--CA 1.454 -0.166 0 C-N-CA 121.13 -0.557 . . . . 0.0 113.141 176.311 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -61.4 -26.46 67.87 Favored 'General case' 0 C--N 1.33 -0.262 0 O-C-N 122.704 -0.292 . . . . 0.0 111.631 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.462 ' HA ' HD11 ' A' ' 19' ' ' ILE . 12.3 ttm180 -64.97 -40.53 95.12 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.826 0.346 . . . . 0.0 110.198 178.336 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -61.66 -43.92 97.94 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.279 178.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -60.65 -42.88 97.86 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.296 178.667 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 75.7 mt -70.26 -41.59 73.27 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.497 -178.641 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -60.35 -46.41 90.03 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.261 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 74.5 m -65.59 -28.35 69.07 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.588 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 69.4 mtm -85.04 -9.26 58.18 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.959 178.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 96.34 24.44 14.31 Favored Glycine 0 C--N 1.33 0.218 0 C-N-CA 120.932 -0.651 . . . . 0.0 112.992 174.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.601 HD13 HD11 ' A' ' 69' ' ' LEU . 84.8 mt -112.28 94.09 4.76 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.897 0.379 . . . . 0.0 110.196 179.387 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.401 HD23 ' N ' ' A' ' 33' ' ' LEU . 1.8 pt? -137.96 159.61 67.85 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.381 -178.004 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.575 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 17.9 Cg_exo -66.23 138.73 52.49 Favored 'Trans proline' 0 N--CA 1.464 -0.256 0 C-N-CA 122.512 2.142 . . . . 0.0 111.495 177.46 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 100.65 -1.02 55.48 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.675 -0.774 . . . . 0.0 111.863 -177.239 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -103.43 -174.76 2.62 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 176.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.438 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -159.79 151.25 19.87 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.717 -176.848 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.578 HD13 HG21 ' A' ' 52' ' ' VAL . 85.4 mt -131.86 138.48 48.47 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.618 178.714 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 -110.37 127.43 55.06 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.924 -178.6 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.538 ' O ' ' HA ' ' A' ' 6' ' ' PRO . 8.5 p -65.5 126.04 23.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.351 0.596 . . . . 0.0 111.216 -175.571 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.651 HG12 ' HG3' ' A' ' 42' ' ' ARG . 65.2 t -96.83 -57.72 4.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.43 -0.804 . . . . 0.0 109.587 172.363 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.651 ' HG3' HG12 ' A' ' 41' ' ' VAL . 57.3 mtp180 -146.93 158.84 44.03 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.597 -179.189 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 61.2 mt -117.71 141.26 37.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.484 ' HB3' ' O ' ' A' ' 48' ' ' ASP . . . -72.21 150.8 92.21 Favored Pre-proline 0 C--O 1.233 0.222 0 CA-C-O 120.606 0.241 . . . . 0.0 110.859 178.851 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -54.89 -18.39 16.37 Favored 'Trans proline' 0 CA--C 1.535 0.534 0 C-N-CA 123.657 2.904 . . . . 0.0 114.854 -174.549 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 77.5 mt -103.41 -31.53 9.96 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 -175.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 118.18 -27.99 7.12 Favored Glycine 0 N--CA 1.453 -0.178 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 -171.284 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.784 ' HB3' ' HD2' ' A' ' 49' ' ' PRO . 0.2 OUTLIER -61.16 170.32 1.67 Allowed Pre-proline 0 C--O 1.221 -0.439 0 CA-C-O 118.346 -0.835 . . . . 0.0 109.113 168.47 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.784 ' HD2' ' HB3' ' A' ' 48' ' ' ASP . 17.1 Cg_exo -18.67 150.77 0.0 OUTLIER 'Trans proline' 0 C--N 1.362 1.273 1 C-N-CA 126.582 4.855 . . . . 0.0 117.988 -153.623 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 67.0 mt -123.91 140.37 47.56 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.971 0 CA-C-N 113.579 -1.646 . . . . 0.0 110.103 -170.703 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -84.37 112.63 20.51 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 178.448 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.578 HG21 HD13 ' A' ' 38' ' ' LEU . 26.7 m -119.41 168.92 11.15 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 120.738 0.304 . . . . 0.0 110.729 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -125.83 142.61 51.43 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.025 -176.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 11.8 m -96.87 -59.5 1.79 Allowed 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 172.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -141.65 -35.22 0.46 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.175 -0.92 . . . . 0.0 109.39 176.11 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -151.21 -35.06 0.14 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.775 173.329 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 2.0 m -67.25 135.04 52.78 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.914 -178.494 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.463 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 5.6 m -96.96 133.31 41.78 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.045 176.305 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.5 mp -115.98 148.08 40.5 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.281 -179.153 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -145.56 114.15 6.78 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.904 177.083 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.552 HD11 HD13 ' A' ' 66' ' ' LEU . 2.9 pp -135.96 153.6 51.36 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.592 -178.17 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.586 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 24.2 mmt180 -64.49 166.53 8.27 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.496 0.665 . . . . 0.0 112.02 -176.057 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 56.8 mtm180 -75.06 -32.94 61.65 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.045 178.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -58.33 -39.8 80.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.827 173.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -75.49 -40.13 57.66 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.601 178.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.695 HD11 HD11 ' A' ' 71' ' ' LEU . 26.9 tp -64.12 -26.62 68.62 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.779 179.614 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.89 -19.67 65.03 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.413 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 96.1 mt -73.47 -25.06 60.31 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.959 0.409 . . . . 0.0 110.545 178.257 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.601 HD11 HD13 ' A' ' 32' ' ' LEU . 75.7 mt -98.11 130.99 44.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.168 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 27.0 m -89.25 114.29 25.62 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 174.243 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.695 HD11 HD11 ' A' ' 66' ' ' LEU . 83.0 mt -110.74 144.2 40.07 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.284 -171.33 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.512 HG23 ' HG3' ' A' ' 11' ' ' ARG . 5.1 m -136.62 135.38 20.38 Favored Pre-proline 0 C--N 1.318 -0.762 0 CA-C-N 115.045 -0.979 . . . . 0.0 109.028 171.35 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.46 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 5.4 Cg_exo -72.93 162.83 40.01 Favored 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 121.897 1.732 . . . . 0.0 112.167 -177.797 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.52 HD12 ' HB2' ' A' ' 9' ' ' SER . 74.8 mt -82.81 -36.02 25.91 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 171.002 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 34.0 t70 . . . . . 0 C--O 1.253 1.26 0 CA-C-N 114.336 -1.302 . . . . 0.0 109.234 170.714 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.4 mmt . . . . . 0 N--CA 1.48 1.064 0 CA-C-O 121.019 0.438 . . . . 0.0 111.306 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.8 m -94.43 53.35 1.67 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.693 -170.054 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -86.98 95.95 10.1 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 173.328 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 63.6 tp -115.94 93.26 4.18 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.906 0.384 . . . . 0.0 111.211 -175.589 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 90.9 mm-40 -134.81 88.69 27.13 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.429 173.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -66.79 135.06 36.98 Favored 'Trans proline' 0 C--O 1.233 0.258 0 C-N-CA 122.562 2.175 . . . . 0.0 112.042 -178.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.457 ' HB3' HG11 ' A' ' 40' ' ' VAL . 22.8 t -80.54 -80.02 0.14 Allowed 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.789 -0.448 . . . . 0.0 109.789 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.446 ' O ' HG12 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -135.56 -179.93 5.95 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.936 0.398 . . . . 0.0 111.085 177.466 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.524 ' HB2' HD12 ' A' ' 74' ' ' LEU . 6.6 m -114.91 139.18 50.0 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.742 -177.112 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 36.3 m-85 -119.97 132.07 55.38 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.672 -178.899 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.432 ' HG3' HG23 ' A' ' 72' ' ' VAL . 1.9 ptp180 -96.68 148.72 22.59 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.025 0.441 . . . . 0.0 110.052 176.258 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.519 HD12 ' HB3' ' A' ' 36' ' ' ALA . 22.1 mt -92.91 114.3 29.45 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.14 -178.594 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 17.8 p -85.05 -22.58 28.93 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.946 0.403 . . . . 0.0 110.443 176.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 161.95 -150.35 19.65 Favored Glycine 0 N--CA 1.441 -0.972 0 C-N-CA 120.41 -0.9 . . . . 0.0 112.094 177.582 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -106.59 164.69 11.86 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 -179.465 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.416 ' HB2' ' O ' ' A' ' 67' ' ' ALA . 33.1 t -52.44 131.73 44.19 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 123.435 0.46 . . . . 0.0 110.767 175.388 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 20.7 Cg_exo -66.35 -5.01 11.67 Favored 'Trans proline' 0 C--N 1.343 0.245 0 C-N-CA 122.843 2.362 . . . . 0.0 112.243 178.711 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -122.09 26.42 8.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.71 178.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 18.4 tt -72.03 151.96 8.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 177.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 26.5 t -130.39 160.04 35.19 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 120.976 0.417 . . . . 0.0 111.77 -171.543 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.6 m120 63.77 -105.55 0.15 Allowed 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.923 172.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -148.68 27.61 1.32 Allowed Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.017 -177.252 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -65.74 -27.75 68.54 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 7.1 ttm180 -56.75 -42.64 79.68 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.383 175.468 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -68.68 -34.56 75.87 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.579 -178.326 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.1 tpp180 -61.94 -47.86 83.01 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.296 0.57 . . . . 0.0 109.749 173.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.408 HD13 HD21 ' A' ' 69' ' ' LEU . 97.8 mt -66.38 -41.77 88.91 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.53 -177.503 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -59.39 -45.22 92.06 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.558 -0.747 . . . . 0.0 110.32 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 45.9 m -65.01 -34.36 78.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.746 179.228 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.532 ' HA ' ' CE ' ' A' ' 30' ' ' MET . 10.3 mmt -73.1 -19.99 61.03 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.079 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 105.81 9.91 31.69 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.556 -0.831 . . . . 0.0 112.132 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.655 HD13 HD11 ' A' ' 69' ' ' LEU . 93.0 mt -98.52 97.94 9.19 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 178.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.8 pp -143.85 160.82 48.76 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.624 -176.274 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -60.96 133.25 46.36 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.513 2.142 . . . . 0.0 111.677 178.291 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 113.88 -17.15 20.4 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.328 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.519 ' HB3' HD12 ' A' ' 12' ' ' ILE . . . -93.27 -178.22 4.69 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-O 121.274 0.559 . . . . 0.0 110.323 179.14 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -149.1 151.88 35.19 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.287 -177.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 71.3 mt -129.24 138.17 51.51 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.211 0.529 . . . . 0.0 110.612 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 34.6 ttm180 -98.01 116.07 29.48 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.129 175.513 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.554 ' HA ' HG12 ' A' ' 52' ' ' VAL . 7.9 p -67.01 128.16 29.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.222 0.534 . . . . 0.0 110.337 -178.882 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.9 HG12 ' HG3' ' A' ' 42' ' ' ARG . 46.8 t -98.91 -53.9 7.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.243 178.066 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.9 ' HG3' HG12 ' A' ' 41' ' ' VAL . 46.3 mtt180 -157.43 138.21 13.2 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -173.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.6 mp -112.35 106.61 21.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 157.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.559 ' HB3' ' HD3' ' A' ' 49' ' ' PRO . . . -53.16 128.89 49.53 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 120.582 0.23 . . . . 0.0 111.387 -173.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -61.25 -6.41 6.6 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 123.465 2.777 . . . . 0.0 112.666 -179.266 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.443 HD13 ' HA ' ' A' ' 46' ' ' LEU . 3.7 mm? -58.82 -34.53 71.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.343 172.482 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 164.9 -76.29 0.15 Allowed Glycine 0 CA--C 1.494 -1.235 0 N-CA-C 109.862 -1.295 . . . . 0.0 109.862 -175.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -176.19 119.92 0.3 Allowed Pre-proline 0 N--CA 1.449 -0.477 0 N-CA-C 114.266 1.21 . . . . 0.0 114.266 171.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.559 ' HD3' ' HB3' ' A' ' 44' ' ' ALA . 55.2 Cg_endo -115.47 166.32 0.03 OUTLIER 'Trans proline' 0 N--CA 1.438 -1.774 1 C-N-CA 125.736 4.291 . . . . 0.0 109.159 134.869 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.604 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 59.5 mt -116.84 100.32 10.09 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.703 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.979 179.708 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.492 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 35.8 mt-30 -92.74 115.38 28.06 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.423 179.605 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.554 HG12 ' HA ' ' A' ' 40' ' ' VAL . 19.8 m -131.53 171.92 17.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.486 -177.208 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -134.63 133.62 40.33 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 17.9 m -82.95 -73.02 0.42 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.779 0.323 . . . . 0.0 111.071 -177.08 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.474 ' HD2' ' O ' ' A' ' 55' ' ' ARG . 7.4 tmm_? -167.82 23.36 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.435 ' HB2' ' O ' ' A' ' 55' ' ' ARG . 52.2 tt0 171.59 -29.76 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.553 -175.446 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.5 t -130.24 143.93 51.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.146 -175.199 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 34.7 t -103.31 146.24 28.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.386 0.612 . . . . 0.0 110.762 -178.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.492 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 2.7 mm? -128.32 166.96 17.63 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.161 -178.496 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.604 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -149.39 133.94 17.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.85 179.129 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -151.59 174.34 13.56 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -175.386 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.491 ' HD2' ' N ' ' A' ' 62' ' ' ARG . 8.4 mpt_? -104.88 167.1 9.93 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 120.891 0.376 . . . . 0.0 111.363 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -43.98 -56.71 3.77 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 115.08 -0.964 . . . . 0.0 112.902 177.8 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -56.0 -40.12 72.89 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.272 0.558 . . . . 0.0 111.149 -176.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -70.76 -31.23 67.96 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.166 -176.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.472 HD11 HD12 ' A' ' 71' ' ' LEU . 18.2 tp -68.26 -39.49 82.18 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.295 176.408 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.416 ' O ' ' HB2' ' A' ' 16' ' ' SER . . . -63.91 -14.11 50.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.859 -177.556 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 83.8 mt -80.33 -16.49 54.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.985 0.421 . . . . 0.0 110.68 177.054 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.655 HD11 HD13 ' A' ' 32' ' ' LEU . 80.2 mt -109.2 151.35 26.6 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.018 176.604 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 26.3 m -107.5 114.26 28.15 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.351 0.596 . . . . 0.0 109.996 172.106 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.511 ' CD2' HG12 ' A' ' 12' ' ' ILE . 58.7 mt -122.45 137.48 54.86 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.162 -0.927 . . . . 0.0 110.335 -175.277 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.435 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 27.6 m -127.91 137.04 29.95 Favored Pre-proline 0 C--N 1.322 -0.605 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 174.746 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.497 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 13.6 Cg_exo -68.32 163.15 37.47 Favored 'Trans proline' 0 N--CA 1.463 -0.319 0 C-N-CA 122.124 1.883 . . . . 0.0 111.911 -178.602 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.524 HD12 ' HB2' ' A' ' 9' ' ' SER . 78.8 mt -79.43 -37.02 38.04 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.359 0.6 . . . . 0.0 110.156 175.078 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 29.7 t70 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.269 -0.872 . . . . 0.0 109.882 177.879 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.0 ptt? . . . . . 0 N--CA 1.478 0.943 0 N-CA-C 110.309 -0.256 . . . . 0.0 110.309 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 63.8 m 69.12 150.87 0.08 Allowed 'General case' 0 C--O 1.233 0.225 0 O-C-N 123.936 0.773 . . . . 0.0 111.769 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -109.51 96.23 6.14 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.784 -179.143 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 88.4 mt -88.8 -80.48 0.29 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.341 177.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 58.05 77.62 0.4 Allowed Pre-proline 0 N--CA 1.465 0.322 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.562 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.35 129.55 17.16 Favored 'Trans proline' 0 C--O 1.233 0.273 0 C-N-CA 122.53 2.153 . . . . 0.0 112.066 179.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 36.6 t -77.33 -68.13 0.65 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.548 178.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.4 ' O ' HG12 ' A' ' 40' ' ' VAL . 53.5 mtp180 -135.44 161.49 35.32 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.046 0.451 . . . . 0.0 110.839 -176.121 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.535 ' HB2' HD12 ' A' ' 74' ' ' LEU . 19.8 m -118.51 141.83 48.19 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.796 179.011 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.528 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 4.6 m-85 -130.02 133.11 46.52 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.25 -174.758 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.603 ' HG2' ' HB2' ' A' ' 37' ' ' ALA . 55.7 mtt-85 -89.1 159.03 17.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.071 0.462 . . . . 0.0 110.751 177.092 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 40.0 mt -100.55 111.39 30.09 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.07 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.24 -27.21 53.24 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.458 0.647 . . . . 0.0 110.256 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.568 ' HA2' ' HB3' ' A' ' 34' ' ' PRO . . . 153.61 -149.83 21.4 Favored Glycine 0 N--CA 1.441 -0.975 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.481 -177.498 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.607 ' CE1' ' HG3' ' A' ' 24' ' ' ARG . 19.5 m-85 -118.11 151.62 37.2 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 -179.307 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.523 ' O ' HG22 ' A' ' 19' ' ' ILE . 25.2 m -64.4 143.05 98.48 Favored Pre-proline 0 N--CA 1.447 -0.581 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 178.369 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 26.0 Cg_exo -62.69 -0.42 1.97 Allowed 'Trans proline' 0 CA--C 1.532 0.424 0 C-N-CA 123.268 2.646 . . . . 0.0 113.901 -173.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.75 -6.59 39.38 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.755 0.312 . . . . 0.0 111.463 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.523 HG22 ' O ' ' A' ' 16' ' ' SER . 12.7 tt -88.01 148.51 4.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 120.974 0.416 . . . . 0.0 110.647 -177.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.511 ' HB3' ' HD2' ' A' ' 23' ' ' TYR . 13.2 t -89.33 162.81 15.62 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.957 179.358 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -69.71 -40.59 76.17 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 -173.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.39 -33.94 86.43 Favored Glycine 0 CA--C 1.517 0.214 0 C-N-CA 120.422 -0.894 . . . . 0.0 112.037 177.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.511 ' HD2' ' HB3' ' A' ' 20' ' ' SER . 41.1 m-85 -67.15 -38.75 86.05 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 120.782 0.325 . . . . 0.0 110.319 175.771 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.607 ' HG3' ' CE1' ' A' ' 15' ' ' TYR . 20.2 ttm180 -59.24 -43.34 92.38 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.899 175.235 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -64.42 -37.14 86.5 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.368 -178.528 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 62.2 ttt180 -72.38 -36.53 68.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.207 178.605 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.423 HD23 ' HE3' ' A' ' 30' ' ' MET . 73.8 mt -68.76 -43.37 75.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.411 179.038 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -58.78 -45.39 89.92 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.92 178.305 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 64.9 m -64.32 -31.6 72.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.588 179.37 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.423 ' HE3' HD23 ' A' ' 27' ' ' LEU . 71.7 mtm -81.33 -15.11 56.34 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.692 -179.576 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 116.96 6.92 13.43 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.406 -0.902 . . . . 0.0 113.611 174.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.4 mt -105.42 98.02 7.78 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 178.326 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.437 ' H ' HD23 ' A' ' 33' ' ' LEU . 1.9 pt? -128.95 150.76 76.14 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.258 -174.538 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.568 ' HB3' ' HA2' ' A' ' 14' ' ' GLY . 37.9 Cg_endo -66.23 135.01 38.46 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.807 2.338 . . . . 0.0 111.534 178.39 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 107.16 -19.73 34.3 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.332 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.32 -171.41 3.56 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-O 121.327 0.584 . . . . 0.0 110.57 -178.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.603 ' HB2' ' HG2' ' A' ' 11' ' ' ARG . . . -148.22 135.9 20.76 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.287 -177.13 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.495 HD13 HG21 ' A' ' 52' ' ' VAL . 51.0 mt -108.8 131.88 54.54 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.159 0.504 . . . . 0.0 110.523 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 6.4 ttp85 -101.94 123.43 45.85 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.321 -0.854 . . . . 0.0 108.831 175.568 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.608 ' HA ' HG12 ' A' ' 52' ' ' VAL . 10.8 p -69.13 127.2 30.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 121.405 0.622 . . . . 0.0 111.391 -175.308 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.5 t -88.44 -50.64 13.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.761 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.927 174.44 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 38.9 ttm180 -175.18 142.97 0.65 Allowed 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.192 0.52 . . . . 0.0 112.033 -178.624 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 98.0 mt -100.86 140.57 19.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 168.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.796 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -82.64 147.93 56.86 Favored Pre-proline 0 C--N 1.324 -0.528 0 O-C-N 122.247 -0.283 . . . . 0.0 111.087 -178.668 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -67.18 -2.05 7.37 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 123.25 2.633 . . . . 0.0 112.915 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.446 ' HA ' HD22 ' A' ' 46' ' ' LEU . 1.0 OUTLIER -56.57 -38.92 72.63 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 122.153 0.978 . . . . 0.0 109.448 174.921 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.55 ' O ' ' HB2' ' A' ' 48' ' ' ASP . . . 153.18 -55.0 0.44 Allowed Glycine 0 N--CA 1.434 -1.489 0 N-CA-C 108.289 -1.924 . . . . 0.0 108.289 -170.935 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.55 ' HB2' ' O ' ' A' ' 47' ' ' GLY . 13.0 t70 169.24 120.31 0.04 OUTLIER Pre-proline 0 N--CA 1.452 -0.373 0 O-C-N 125.155 1.15 . . . . 0.0 113.075 168.318 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.796 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 27.8 Cg_endo -109.94 163.53 0.07 OUTLIER 'Trans proline' 0 N--CA 1.433 -2.038 1 C-N-CA 125.307 4.005 . . . . 0.0 108.097 137.324 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.819 HG22 HG13 ' A' ' 52' ' ' VAL . 30.8 mt -115.87 103.97 16.02 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 C-N-CA 119.31 -0.956 . . . . 0.0 110.672 -177.678 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.462 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 97.9 mt-30 -84.63 113.17 21.08 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 173.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.819 HG13 HG22 ' A' ' 50' ' ' ILE . 15.5 m -132.98 165.68 31.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 120.887 0.375 . . . . 0.0 111.481 -177.384 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -147.26 141.04 25.72 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.523 -0.918 . . . . 0.0 108.523 176.048 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 8.9 t -95.89 -47.7 6.03 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.169 -0.612 . . . . 0.0 109.699 176.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 55' ' ' ARG . 13.9 ptt180 177.24 24.04 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.474 0.71 . . . . 0.0 109.554 175.105 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -127.32 -65.71 0.92 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.082 -172.083 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.3 t -164.47 153.73 13.47 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.052 -178.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.403 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 10.5 m -71.89 141.39 49.54 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.135 0.493 . . . . 0.0 111.139 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.462 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 65.8 tp -139.9 144.6 37.23 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.031 178.177 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.419 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -112.56 141.39 46.38 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.605 179.555 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.59 HD11 HD12 ' A' ' 50' ' ' ILE . 4.0 pp -142.29 161.43 38.05 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 -179.208 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.677 ' HD3' ' OD2' ' A' ' 65' ' ' ASP . 2.8 mpt_? -96.75 175.37 6.39 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.005 0.431 . . . . 0.0 109.979 -177.22 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.1 mmt180 -66.2 -33.52 75.95 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.508 177.163 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -66.87 -35.3 79.7 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.664 177.171 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.677 ' OD2' ' HD3' ' A' ' 62' ' ' ARG . 41.4 m-20 -68.23 -42.5 79.64 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-O 121.422 0.629 . . . . 0.0 109.366 175.111 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 45.5 tp -60.21 -32.37 71.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.875 178.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.84 -21.57 66.48 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.453 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 89.6 mt -86.03 -18.61 32.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.92 0.39 . . . . 0.0 110.996 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 88.7 mt -104.39 141.85 35.61 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.709 -177.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 20.2 m -101.29 115.67 31.03 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 172.334 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 73.2 mt -117.83 147.69 42.81 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.246 -176.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.424 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 4.6 m -128.26 115.33 20.02 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.645 172.287 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.528 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 21.9 Cg_exo -65.31 161.62 36.94 Favored 'Trans proline' 0 N--CA 1.464 -0.251 0 C-N-CA 122.134 1.889 . . . . 0.0 112.323 -177.837 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.535 HD12 ' HB2' ' A' ' 9' ' ' SER . 97.6 mt -93.56 -15.48 25.4 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 121.341 0.591 . . . . 0.0 109.705 176.413 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.4 t70 . . . . . 0 C--O 1.244 0.809 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.407 176.739 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.5 mtt . . . . . 0 N--CA 1.482 1.13 0 CA-C-O 120.685 0.279 . . . . 0.0 110.41 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.6 p -177.71 35.66 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.135 -178.603 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.52 72.76 6.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.346 -175.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.7 pp -162.47 159.16 24.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.147 0.499 . . . . 0.0 111.229 178.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -151.85 77.01 7.17 Favored Pre-proline 0 C--N 1.322 -0.608 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 177.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -83.89 149.13 12.36 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 122.478 2.119 . . . . 0.0 112.069 -178.102 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.6 t -166.16 -61.76 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.868 0.366 . . . . 0.0 111.079 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -103.71 173.21 6.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.621 0.724 . . . . 0.0 112.057 -172.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.446 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 13.4 t -137.92 140.42 40.3 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.66 172.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.404 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 19.3 m-85 -123.87 129.11 50.47 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.261 -175.424 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.421 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 36.3 mtt-85 -88.96 146.84 24.64 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 177.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.516 HG12 ' CD2' ' A' ' 71' ' ' LEU . 36.7 mt -90.91 111.59 23.88 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 175.429 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 18.5 m -79.08 -22.24 45.58 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.341 0.591 . . . . 0.0 110.336 178.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.655 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 156.94 -142.78 8.96 Favored Glycine 0 N--CA 1.443 -0.873 0 C-N-CA 120.834 -0.698 . . . . 0.0 111.785 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.577 ' HB3' HG21 ' A' ' 19' ' ' ILE . 34.0 m-85 -121.82 151.16 40.92 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.64 ' O ' HG22 ' A' ' 19' ' ' ILE . 74.3 p -69.59 159.16 84.89 Favored Pre-proline 0 N--CA 1.445 -0.68 0 CA-C-O 120.683 0.278 . . . . 0.0 111.002 -177.226 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_exo -73.44 11.57 0.99 Allowed 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 122.533 2.155 . . . . 0.0 111.961 174.529 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -103.77 -14.26 16.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.766 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.64 HG22 ' O ' ' A' ' 16' ' ' SER . 13.0 tt -89.43 142.96 12.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 120.77 0.319 . . . . 0.0 110.166 179.572 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.7 t -161.36 -174.69 4.41 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.624 0.25 . . . . 0.0 110.368 -174.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.1 t30 59.15 34.91 23.49 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.284 0.634 . . . . 0.0 111.793 174.061 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.39 6.0 87.84 Favored Glycine 0 CA--C 1.519 0.293 0 C-N-CA 120.838 -0.696 . . . . 0.0 114.011 174.707 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -62.22 -22.83 66.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 117.31 0.555 . . . . 0.0 110.889 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.494 ' HG2' ' CG ' ' A' ' 15' ' ' TYR . 34.6 mtt85 -63.95 -42.84 97.18 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.746 174.655 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -66.88 -35.79 80.83 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 121.231 0.539 . . . . 0.0 109.802 177.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 86.1 mtt180 -62.13 -44.14 97.28 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.814 176.302 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.612 HD22 HD12 ' A' ' 32' ' ' LEU . 38.2 mt -69.56 -41.71 75.5 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.493 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -58.14 -47.44 83.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.415 178.297 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 59.3 m -63.34 -28.68 70.17 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.571 -179.463 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.422 ' HE3' HD23 ' A' ' 27' ' ' LEU . 67.9 mtm -84.71 -12.99 52.68 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.424 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 114.76 -0.28 23.1 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.471 -0.871 . . . . 0.0 113.261 174.385 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.821 HD13 HD11 ' A' ' 69' ' ' LEU . 88.7 mt -96.05 100.44 12.1 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.968 0.413 . . . . 0.0 110.107 -178.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 pp -138.89 155.42 73.09 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.069 -175.395 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.655 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 23.0 Cg_exo -64.4 137.61 56.39 Favored 'Trans proline' 0 C--O 1.234 0.308 0 C-N-CA 122.9 2.4 . . . . 0.0 112.052 179.528 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 111.04 -28.12 10.14 Favored Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.313 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.03 154.08 21.04 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-O 121.122 0.486 . . . . 0.0 110.105 -179.041 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.421 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -129.94 138.17 50.74 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.973 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.65 ' HB3' ' HB ' ' A' ' 52' ' ' VAL . 2.2 mm? -106.87 142.19 36.9 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.268 179.803 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 35.5 ttt180 -94.16 132.85 38.28 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 173.318 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.591 ' HA ' HG12 ' A' ' 52' ' ' VAL . 7.6 p -71.64 128.28 34.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.157 0.504 . . . . 0.0 111.084 -175.597 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.0 t -99.35 -44.87 11.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.611 176.447 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 57.9 ttt180 -176.52 135.79 0.25 Allowed 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 -177.501 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.424 HG23 ' HD2' ' A' ' 49' ' ' PRO . 4.8 mp -116.6 128.76 73.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 166.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.428 ' H ' ' CD ' ' A' ' 49' ' ' PRO . . . -67.12 125.49 91.05 Favored Pre-proline 0 C--N 1.32 -0.675 0 C-N-CA 121.048 -0.261 . . . . 0.0 110.442 176.462 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -57.36 -14.45 15.98 Favored 'Trans proline' 0 N--CA 1.475 0.428 0 C-N-CA 123.426 2.751 . . . . 0.0 113.107 -179.098 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -54.92 -33.24 61.95 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.315 176.618 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 164.37 -75.64 0.16 Allowed Glycine 0 N--CA 1.435 -1.419 0 N-CA-C 110.981 -0.848 . . . . 0.0 110.981 -177.425 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -164.68 118.53 0.99 Allowed Pre-proline 0 N--CA 1.443 -0.818 0 N-CA-C 114.522 1.304 . . . . 0.0 114.522 179.364 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.428 ' CD ' ' H ' ' A' ' 44' ' ' ALA . 82.3 Cg_endo -118.61 -175.5 0.02 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.714 1 C-N-CA 126.994 5.129 . . . . 0.0 107.988 132.738 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.509 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 67.3 mt -145.11 104.43 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.237 0 C-N-CA 120.117 -0.633 . . . . 0.0 109.882 173.253 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.443 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 8.9 tt0 -92.96 120.64 33.49 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 174.233 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.65 ' HB ' ' HB3' ' A' ' 38' ' ' LEU . 7.6 m -140.53 162.02 23.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.777 0.322 . . . . 0.0 111.025 -176.841 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -119.12 135.61 54.57 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.024 -0.534 . . . . 0.0 109.689 -178.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.0 t -88.91 -33.12 17.4 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.704 -0.399 . . . . 0.0 110.044 179.336 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 35.1 ttm180 178.24 -61.25 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.308 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -107.31 -38.33 5.99 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.513 178.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.0 t -109.0 150.2 28.1 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.901 0.381 . . . . 0.0 110.845 -174.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.2 p -114.38 144.91 42.53 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.649 179.196 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.443 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 6.2 mp -127.45 162.01 27.38 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.987 -176.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.509 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -131.41 142.18 49.98 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.858 177.097 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.498 HD13 ' HB2' ' A' ' 65' ' ' ASP . 3.9 pp -153.82 177.34 11.11 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 -174.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.409 ' HD2' ' O ' ' A' ' 61' ' ' LEU . 15.1 mmm-85 -121.92 -175.04 3.02 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.931 0.872 . . . . 0.0 111.521 -178.673 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.0 ptp180 -56.04 -34.0 65.47 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 113.757 -1.565 . . . . 0.0 111.669 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -63.11 -44.61 95.15 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.478 179.297 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.498 ' HB2' HD13 ' A' ' 61' ' ' LEU . 7.7 m-20 -67.63 -39.45 84.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.246 0.546 . . . . 0.0 109.601 178.122 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 66.3 tp -60.03 -39.64 86.58 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.289 -0.868 . . . . 0.0 110.878 177.37 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.45 -12.84 61.61 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.231 -0.441 . . . . 0.0 112.118 -176.483 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.497 ' HB3' HD12 ' A' ' 19' ' ' ILE . 93.8 mt -93.32 -21.33 19.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.79 0.329 . . . . 0.0 110.81 179.459 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.821 HD11 HD13 ' A' ' 32' ' ' LEU . 96.9 mt -107.25 140.32 40.32 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.463 -175.102 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.5 m -91.27 112.29 24.14 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 169.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.516 ' CD2' HG12 ' A' ' 12' ' ' ILE . 82.6 mt -120.92 128.05 52.41 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.307 -174.485 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.417 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 34.9 m -124.93 133.03 24.45 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.119 176.797 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 72' ' ' VAL . 18.5 Cg_exo -65.04 163.29 29.2 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.087 1.858 . . . . 0.0 111.414 179.223 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 9' ' ' SER . 91.3 mt -53.81 -57.62 10.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.216 0.531 . . . . 0.0 109.714 173.562 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.6 t70 . . . . . 0 C--O 1.251 1.132 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.416 176.413 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.8 tpt . . . . . 0 N--CA 1.483 1.201 0 CA-C-O 120.764 0.316 . . . . 0.0 110.355 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.5 m -117.3 113.64 22.44 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.351 179.054 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -86.74 156.5 19.91 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.588 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.8 tt 61.64 98.28 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.365 0 O-C-N 123.928 0.767 . . . . 0.0 110.263 -176.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.404 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 12.4 pt20 -125.66 125.39 24.97 Favored Pre-proline 0 C--N 1.321 -0.674 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.473 -179.16 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 5' ' ' GLN . 23.9 Cg_exo -62.9 118.89 5.79 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 122.443 2.095 . . . . 0.0 110.655 175.814 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.0 t -106.93 -63.07 1.32 Allowed 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.597 -170.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 47.8 ttt85 -111.12 144.57 40.05 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.56 -171.384 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.1 t -123.21 139.78 53.7 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.925 -178.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.648 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 8.3 m-85 -116.66 133.19 56.31 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -178.307 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.456 ' CZ ' HD23 ' A' ' 74' ' ' LEU . 11.2 ptp180 -102.73 157.91 16.62 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 175.654 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.493 HG12 ' CD2' ' A' ' 71' ' ' LEU . 19.6 mt -104.66 115.04 45.81 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.131 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.018 -178.381 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 1.5 p -93.05 -16.27 25.19 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.664 0.269 . . . . 0.0 111.255 178.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.541 ' HA2' ' HB3' ' A' ' 34' ' ' PRO . . . 165.13 -153.84 24.24 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.487 -0.863 . . . . 0.0 112.28 178.034 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.52 ' CE1' ' HD3' ' A' ' 34' ' ' PRO . 60.9 m-85 -119.86 153.32 36.0 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 -178.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.591 ' O ' HG22 ' A' ' 19' ' ' ILE . 29.2 m -67.89 138.47 92.85 Favored Pre-proline 0 N--CA 1.441 -0.875 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 176.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -65.98 6.82 0.42 Allowed 'Trans proline' 0 CA--C 1.532 0.415 0 C-N-CA 122.771 2.314 . . . . 0.0 113.481 -175.568 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -106.39 7.77 31.29 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.705 179.053 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.591 HG22 ' O ' ' A' ' 16' ' ' SER . 13.5 tt -96.97 132.87 40.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 CA-C-O 121.034 0.445 . . . . 0.0 110.464 177.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.9 t -156.75 -161.54 1.11 Allowed 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 -176.241 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 67.51 16.55 9.96 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.652 0.739 . . . . 0.0 110.924 175.583 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 79.69 4.05 89.23 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.51 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -66.11 -27.67 68.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.223 0.535 . . . . 0.0 110.245 -178.094 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 27.4 ttm180 -64.02 -41.95 97.27 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.023 176.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -69.69 -32.86 71.71 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.508 177.777 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -64.08 -43.33 95.75 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.997 0.427 . . . . 0.0 109.969 175.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.565 HD22 HD12 ' A' ' 32' ' ' LEU . 57.8 mt -64.3 -45.69 86.87 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.092 176.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -56.69 -45.33 81.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.417 178.146 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 48.8 m -63.19 -33.38 75.34 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.048 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 71.5 mtm -81.79 -10.44 59.34 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.434 -179.499 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 108.1 5.0 33.2 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.661 -0.78 . . . . 0.0 113.138 174.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.595 HD13 HD11 ' A' ' 69' ' ' LEU . 97.5 mt -94.0 91.0 6.66 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 177.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.8 pp -135.75 157.85 75.32 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.336 -174.721 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.541 ' HB3' ' HA2' ' A' ' 14' ' ' GLY . 32.3 Cg_endo -65.69 124.01 12.18 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.698 2.265 . . . . 0.0 111.627 177.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.56 -7.41 17.95 Favored Glycine 0 N--CA 1.444 -0.819 0 C-N-CA 120.818 -0.706 . . . . 0.0 111.843 -176.317 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -97.27 -172.52 2.44 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-O 120.985 0.422 . . . . 0.0 110.553 178.189 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.452 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -160.13 149.71 17.86 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.654 -176.464 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 58.8 mt -125.22 138.53 54.12 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.781 178.714 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 36.9 ttp180 -111.5 124.22 51.84 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 176.396 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.555 ' HA ' HG12 ' A' ' 52' ' ' VAL . 7.4 p -61.58 127.79 21.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-O 121.109 0.481 . . . . 0.0 112.11 -174.458 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 92.7 t -102.71 -50.9 9.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.917 171.306 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.402 ' HG3' ' HB2' ' A' ' 51' ' ' GLN . 5.9 ptm180 -170.67 161.05 7.37 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.122 0.487 . . . . 0.0 111.785 -178.696 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 82.5 mt -135.1 143.19 37.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 171.623 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.761 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -69.13 142.34 92.78 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 117.88 0.309 . . . . 0.0 110.841 179.065 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 22.7 Cg_exo -66.06 -8.92 21.52 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 123.184 2.589 . . . . 0.0 113.25 -177.702 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.419 HD13 ' HA ' ' A' ' 46' ' ' LEU . 4.0 mm? -65.86 -88.48 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.643 0.735 . . . . 0.0 110.443 176.644 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -123.95 -74.53 0.27 Allowed Glycine 0 CA--C 1.491 -1.444 0 N-CA-C 109.425 -1.47 . . . . 0.0 109.425 172.479 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.442 ' OD2' ' HB3' ' A' ' 63' ' ' ARG . 4.9 p-10 -178.44 124.41 0.26 Allowed Pre-proline 0 N--CA 1.44 -0.955 0 N-CA-C 113.995 1.109 . . . . 0.0 113.995 174.398 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.761 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 15.1 Cg_endo -105.45 157.82 0.16 Allowed 'Trans proline' 0 N--CA 1.437 -1.812 0 C-N-CA 125.005 3.803 . . . . 0.0 107.458 136.539 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.625 HG22 HG13 ' A' ' 52' ' ' VAL . 4.5 mp -119.8 104.88 16.29 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.706 0 C-N-CA 118.988 -1.085 . . . . 0.0 110.365 -175.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.434 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 26.1 mp0 -88.65 117.85 27.9 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.078 174.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.625 HG13 HG22 ' A' ' 50' ' ' ILE . 14.1 m -132.94 172.44 16.46 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.51 -178.726 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.572 ' HG2' ' H ' ' A' ' 55' ' ' ARG . 34.0 tt0 -117.58 130.83 56.64 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.004 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 17.8 p -92.53 17.89 9.41 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.088 -179.209 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.572 ' H ' ' HG2' ' A' ' 53' ' ' GLU . 0.0 OUTLIER 63.32 21.09 12.63 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.818 0.818 . . . . 0.0 109.005 -173.935 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -141.72 -62.37 0.46 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.993 -1.003 . . . . 0.0 108.512 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.7 t -142.92 174.72 10.42 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.679 178.415 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 17.8 m -82.49 143.45 31.11 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.99 0.424 . . . . 0.0 110.331 178.672 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.434 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 43.8 tp -134.14 144.62 48.65 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.572 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.539 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -133.07 139.72 47.3 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.74 -0.663 . . . . 0.0 109.574 177.604 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.0 pp -154.84 178.81 9.73 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -176.313 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 25.6 mmt85 -115.73 170.55 8.37 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 121.92 0.866 . . . . 0.0 112.206 -178.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.442 ' HB3' ' OD2' ' A' ' 48' ' ' ASP . 13.1 ptt-85 -62.14 -36.15 80.91 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 113.611 -1.631 . . . . 0.0 111.766 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.428 ' HE3' ' HB3' ' A' ' 64' ' ' LYS . 1.3 tmmt? -58.16 -45.85 86.74 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.923 0.392 . . . . 0.0 110.624 178.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -71.74 -37.75 70.52 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.324 0.583 . . . . 0.0 110.137 178.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 18.7 tp -64.12 -33.25 75.34 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.78 -179.052 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.27 -18.37 63.13 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.777 -178.376 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.438 ' HB3' HD12 ' A' ' 19' ' ' ILE . 91.2 mt -88.76 -7.49 56.14 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.757 0.313 . . . . 0.0 110.959 -179.701 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.595 HD11 HD13 ' A' ' 32' ' ' LEU . 94.7 mt -103.49 141.75 35.46 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.545 178.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 25.1 m -96.77 114.52 26.16 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 172.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.493 ' CD2' HG12 ' A' ' 12' ' ' ILE . 74.5 mt -121.79 134.98 54.91 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.047 -172.53 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.446 ' O ' ' HG2' ' A' ' 11' ' ' ARG . 17.1 m -127.61 128.48 23.94 Favored Pre-proline 0 C--N 1.319 -0.725 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 170.573 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.648 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 36.9 Cg_endo -65.63 163.4 30.36 Favored 'Trans proline' 0 C--O 1.234 0.29 0 C-N-CA 122.526 2.151 . . . . 0.0 113.545 -173.231 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.456 HD23 ' CZ ' ' A' ' 11' ' ' ARG . 95.7 mt -94.63 -71.77 0.65 Allowed 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.292 -0.867 . . . . 0.0 108.708 173.125 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 . . . . . 0 C--O 1.253 1.249 0 CA-C-O 117.748 -1.12 . . . . 0.0 109.304 175.603 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.8 mtm . . . . . 0 N--CA 1.481 1.087 0 CA-C-O 120.837 0.351 . . . . 0.0 110.775 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.9 p -144.28 104.59 4.12 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.589 175.463 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -80.76 76.73 7.65 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.239 -171.42 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -161.42 140.99 10.33 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.312 172.196 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -138.67 91.6 11.96 Favored Pre-proline 0 C--N 1.319 -0.747 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 176.445 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.561 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 19.1 Cg_exo -66.53 126.99 16.4 Favored 'Trans proline' 0 N--CA 1.461 -0.432 0 C-N-CA 122.956 2.437 . . . . 0.0 112.276 -177.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 23.4 t -79.43 -66.37 0.88 Allowed 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 176.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.407 ' H ' HG12 ' A' ' 40' ' ' VAL . 88.3 mtt180 -149.34 153.47 37.5 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 120.857 0.36 . . . . 0.0 110.775 177.02 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.514 ' HB2' HD12 ' A' ' 74' ' ' LEU . 2.2 m -95.79 135.56 37.35 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.921 179.414 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.542 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 44.8 m-85 -113.97 141.09 47.83 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.213 -177.712 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.53 ' HD2' HD23 ' A' ' 74' ' ' LEU . 45.4 mtp180 -97.96 144.94 26.98 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 178.652 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.439 HG12 ' CD2' ' A' ' 71' ' ' LEU . 18.7 mt -99.02 113.67 34.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 177.235 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 12.6 p -102.0 -3.63 27.4 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -175.481 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.491 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 160.46 -161.73 32.84 Favored Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 119.946 -1.121 . . . . 0.0 112.445 175.541 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -118.93 156.61 29.25 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 36.9 t -66.1 137.36 95.74 Favored Pre-proline 0 C--N 1.319 -0.726 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 170.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -59.22 -14.81 25.77 Favored 'Trans proline' 0 CA--C 1.529 0.272 0 C-N-CA 122.838 2.359 . . . . 0.0 112.867 -176.5 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -78.3 -8.59 58.57 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.746 -178.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 15.7 tt -63.16 129.12 26.29 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-O 121.163 0.506 . . . . 0.0 110.523 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.3 t -134.21 178.16 7.19 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.318 -172.031 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 58.58 -158.99 0.29 Allowed 'General case' 0 CA--C 1.534 0.352 0 O-C-N 123.651 0.594 . . . . 0.0 109.59 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -94.09 25.62 21.11 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.817 -0.706 . . . . 0.0 111.782 176.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.447 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 4.9 t80 -64.48 -32.3 73.87 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.024 0.44 . . . . 0.0 110.154 -177.483 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 14.4 ttm180 -58.9 -42.11 88.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.464 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -65.61 -39.73 91.85 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.409 -179.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 34.1 ttt180 -66.17 -39.49 89.79 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.972 178.115 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 23' ' ' TYR . 85.2 mt -66.83 -44.3 81.44 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.349 179.298 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -57.62 -44.75 85.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.115 177.349 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 47.2 m -63.21 -34.17 77.06 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.172 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.525 ' HA ' ' CE ' ' A' ' 30' ' ' MET . 15.9 mmt -74.34 -24.67 59.22 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.848 -179.667 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.06 6.04 14.35 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.498 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.677 HD13 HD11 ' A' ' 69' ' ' LEU . 68.7 mt -97.66 90.86 5.15 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.2 pp -141.29 155.15 67.95 Favored Pre-proline 0 C--N 1.322 -0.604 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.065 -174.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.491 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 24.0 Cg_exo -63.72 127.05 18.71 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.815 2.343 . . . . 0.0 111.931 178.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.64 5.67 44.86 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.081 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -107.52 -179.45 3.92 Favored 'General case' 0 N--CA 1.442 -0.853 0 CA-C-O 120.968 0.413 . . . . 0.0 109.957 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -148.55 145.59 27.92 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.093 -177.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.471 HD13 HG21 ' A' ' 52' ' ' VAL . 45.6 mt -129.39 131.12 46.74 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.45 177.924 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.476 ' HA ' ' HA ' ' A' ' 9' ' ' SER . 38.3 ttm180 -100.61 118.84 37.58 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.222 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.634 ' HA ' HG12 ' A' ' 52' ' ' VAL . 7.5 p -65.32 131.09 31.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.56 0.695 . . . . 0.0 111.506 -174.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.754 HG12 ' HG3' ' A' ' 42' ' ' ARG . 59.2 t -95.84 -54.97 6.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.942 174.111 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.754 ' HG3' HG12 ' A' ' 41' ' ' VAL . 54.9 mtp180 -155.23 143.49 20.24 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -176.168 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.432 HG23 ' HD2' ' A' ' 49' ' ' PRO . 4.7 mp -114.87 119.43 61.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 161.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.417 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -56.91 127.87 75.77 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-O 120.525 0.202 . . . . 0.0 111.129 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 38.4 Cg_exo -62.33 -8.56 12.83 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 123.415 2.743 . . . . 0.0 112.61 -179.18 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -56.24 -38.36 70.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.554 173.589 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 170.52 -77.01 0.1 OUTLIER Glycine 0 N--CA 1.438 -1.172 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 -176.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -169.85 120.74 0.58 Allowed Pre-proline 0 N--CA 1.452 -0.361 0 CA-C-O 122.257 1.027 . . . . 0.0 113.666 177.466 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.432 ' HD2' HG23 ' A' ' 43' ' ' ILE . 89.7 Cg_endo -117.96 -166.79 0.01 OUTLIER 'Trans proline' 0 N--CA 1.438 -1.786 1 C-N-CA 126.337 4.691 . . . . 0.0 107.777 139.206 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.741 HG22 HG13 ' A' ' 52' ' ' VAL . 54.5 mt -143.8 101.9 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.239 0 C-N-CA 120.255 -0.578 . . . . 0.0 109.628 168.124 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.514 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 54.2 mt-30 -87.91 119.09 27.93 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 175.876 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.741 HG13 HG22 ' A' ' 50' ' ' ILE . 17.7 m -132.68 171.88 17.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 120.802 0.335 . . . . 0.0 111.56 -175.379 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.498 ' HG3' ' H ' ' A' ' 55' ' ' ARG . 10.1 tp10 -138.82 141.19 38.71 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 176.201 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.1 t -124.13 18.53 9.16 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.639 0.733 . . . . 0.0 109.644 -176.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.498 ' H ' ' HG3' ' A' ' 53' ' ' GLU . 74.6 mtm180 74.52 23.7 1.87 Allowed 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.66 178.883 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -140.91 -52.92 0.47 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.275 0.56 . . . . 0.0 110.062 -178.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 59.9 m -153.84 135.67 14.54 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.472 -0.785 . . . . 0.0 109.428 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.5 m -76.65 131.52 38.89 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 175.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.514 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 3.0 mm? -121.64 171.75 8.61 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.98 0.419 . . . . 0.0 111.495 -176.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.539 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -146.25 141.79 27.72 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 174.172 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.458 ' C ' ' HD2' ' A' ' 62' ' ' ARG . 4.1 pp -146.18 155.45 42.72 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 120.693 -0.403 . . . . 0.0 110.167 -173.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.603 ' HD2' ' N ' ' A' ' 62' ' ' ARG . 4.2 mpt_? -104.39 164.79 11.49 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.585 -178.085 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.403 ' HA ' ' HB3' ' A' ' 66' ' ' LEU . 45.5 mtm180 -50.76 -36.05 34.8 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 114.858 -1.065 . . . . 0.0 112.925 -178.553 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -59.19 -49.33 78.26 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.761 0.315 . . . . 0.0 110.824 178.33 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -72.39 -34.37 67.88 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.035 0.445 . . . . 0.0 110.194 178.891 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.408 HD13 HD12 ' A' ' 50' ' ' ILE . 62.6 tp -62.71 -37.05 84.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.005 178.213 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.71 -18.56 65.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.731 -178.032 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 96.0 mt -94.77 -4.59 47.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.566 -178.02 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.677 HD11 HD13 ' A' ' 32' ' ' LEU . 92.1 mt -111.5 129.24 56.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.778 0.323 . . . . 0.0 111.521 -176.77 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.9 m -88.55 115.95 26.44 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 172.051 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.439 ' CD2' HG12 ' A' ' 12' ' ' ILE . 70.5 mt -124.93 135.33 52.74 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.021 -174.489 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 24.1 m -133.76 132.64 21.7 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.455 173.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.542 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 17.1 Cg_exo -66.07 164.05 29.06 Favored 'Trans proline' 0 CA--C 1.533 0.427 0 C-N-CA 122.48 2.12 . . . . 0.0 113.196 -175.398 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.53 HD23 ' HD2' ' A' ' 11' ' ' ARG . 39.2 mt -67.69 -26.32 66.12 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.207 175.631 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 37.1 t70 . . . . . 0 C--O 1.248 1.001 0 O-C-N 124.102 0.876 . . . . 0.0 110.707 -178.186 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 49.2 ttm . . . . . 0 N--CA 1.478 0.937 0 CA-C-O 121.161 0.505 . . . . 0.0 109.991 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.5 m -127.34 119.21 25.71 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.437 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -86.31 111.74 20.75 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.958 0.409 . . . . 0.0 111.345 -177.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.791 HD22 ' HG2' ' A' ' 42' ' ' ARG . 9.9 mp -88.54 137.86 31.94 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 175.764 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.449 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 73.4 mt-30 -82.86 128.35 66.14 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.675 -176.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 5' ' ' GLN . 31.5 Cg_exo -61.17 123.98 13.93 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 122.826 2.351 . . . . 0.0 111.788 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.2 t -104.18 -77.04 0.58 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.825 -173.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -95.93 169.95 9.63 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.441 0.639 . . . . 0.0 111.78 -175.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.573 ' HB3' HD12 ' A' ' 74' ' ' LEU . 23.4 t -140.29 140.28 35.66 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 114.994 -1.003 . . . . 0.0 109.483 176.753 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.585 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 15.0 m-85 -121.14 128.33 52.43 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 -178.17 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.467 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 67.6 mtp180 -97.81 149.87 21.88 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.515 178.49 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 25.5 mt -88.08 117.2 31.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.545 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 8.8 t -94.8 -18.47 21.2 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.944 0.402 . . . . 0.0 110.271 -179.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 166.89 -161.66 35.46 Favored Glycine 0 N--CA 1.443 -0.849 0 C-N-CA 120.449 -0.881 . . . . 0.0 112.269 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -105.81 158.35 16.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.677 0.275 . . . . 0.0 110.446 -178.253 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.459 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 31.3 t -52.05 134.24 39.69 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.945 175.739 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 17.7 Cg_exo -67.77 2.53 2.44 Favored 'Trans proline' 0 C--O 1.235 0.374 0 C-N-CA 122.954 2.436 . . . . 0.0 112.649 178.5 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -115.52 6.7 14.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.916 178.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.457 HG22 ' O ' ' A' ' 16' ' ' SER . 10.8 tt -87.9 150.48 3.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.908 0.385 . . . . 0.0 110.812 -177.831 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 35.4 t -89.67 158.69 17.47 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.156 178.113 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.459 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 88.1 m-20 -54.95 -44.3 74.2 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.237 -179.237 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.1 -36.67 92.22 Favored Glycine 0 C--N 1.329 0.173 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.833 -176.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -72.71 -31.19 64.82 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.435 ' HB3' ' O ' ' A' ' 21' ' ' ASN . 12.8 ttt180 -62.0 -43.79 98.1 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.746 172.598 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.459 ' HG3' ' O ' ' A' ' 21' ' ' ASN . 77.5 mt-30 -61.1 -41.88 97.48 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.565 177.182 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -57.83 -48.53 79.51 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.326 175.599 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.53 HD22 HD12 ' A' ' 32' ' ' LEU . 41.2 mt -67.55 -40.15 84.99 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.682 -176.677 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -60.34 -46.14 90.95 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.026 178.445 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 46.1 m -65.99 -31.49 72.42 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.141 179.367 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 82.5 mtp -71.03 -24.52 62.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.536 177.456 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 112.39 6.54 23.62 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.89 -0.671 . . . . 0.0 112.184 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.573 HD13 HD11 ' A' ' 69' ' ' LEU . 85.8 mt -98.31 97.3 8.69 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.989 0.423 . . . . 0.0 110.051 -178.272 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.4 pp -142.06 157.6 63.5 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.871 -176.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.66 139.38 88.59 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.731 2.287 . . . . 0.0 112.357 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 112.07 -21.07 20.87 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.328 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -85.53 -177.51 6.45 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 121.048 0.452 . . . . 0.0 110.35 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.467 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -159.65 134.93 8.22 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.91 -176.369 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.462 ' N ' HD22 ' A' ' 38' ' ' LEU . 2.2 mm? -108.55 141.18 40.85 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.622 176.486 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.449 ' HG2' ' HB3' ' A' ' 6' ' ' PRO . 20.5 ttm180 -109.09 127.72 54.38 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 176.656 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.572 ' HA ' HG12 ' A' ' 52' ' ' VAL . 9.9 p -67.27 127.71 29.29 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-O 121.309 0.576 . . . . 0.0 111.662 -172.6 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.8 t -106.73 -50.68 7.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.703 173.574 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.791 ' HG2' HD22 ' A' ' 4' ' ' LEU . 1.1 mtp180 -156.92 159.66 38.34 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -174.346 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.419 HG23 ' HD2' ' A' ' 49' ' ' PRO . 80.0 mt -127.45 142.53 43.33 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 162.397 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.646 ' H ' ' CD ' ' A' ' 49' ' ' PRO . . . -84.14 140.27 39.65 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-O 120.554 0.216 . . . . 0.0 111.523 -177.864 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -65.8 -7.39 16.5 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 123.107 2.538 . . . . 0.0 112.152 176.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.598 HD13 ' HB1' ' A' ' 44' ' ' ALA . 10.0 mp -57.76 -28.82 64.29 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.752 0.787 . . . . 0.0 110.336 173.36 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 153.95 -76.97 0.21 Allowed Glycine 0 N--CA 1.432 -1.633 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 -175.544 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -170.92 124.2 0.59 Allowed Pre-proline 0 N--CA 1.435 -1.195 0 CA-C-O 122.321 1.057 . . . . 0.0 113.094 174.331 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.646 ' CD ' ' H ' ' A' ' 44' ' ' ALA . 97.9 Cg_endo -115.04 -162.16 0.02 OUTLIER 'Trans proline' 0 N--CA 1.432 -2.146 1 C-N-CA 125.749 4.299 . . . . 0.0 107.686 143.3 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.791 HG22 HG13 ' A' ' 52' ' ' VAL . 52.5 mt -141.83 102.63 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.282 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 166.855 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -79.23 118.73 21.43 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 177.527 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.791 HG13 HG22 ' A' ' 50' ' ' ILE . 17.3 m -136.87 173.7 13.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-O 120.808 0.337 . . . . 0.0 111.313 -176.184 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -124.66 142.99 50.98 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 176.77 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 8.6 m -110.31 -39.25 5.02 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.683 -177.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 16.0 ptt180 179.46 -45.38 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.099 -0.5 . . . . 0.0 112.031 -177.189 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -132.27 -14.1 3.01 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -171.276 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.8 t -156.19 129.95 8.43 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.078 0.466 . . . . 0.0 110.279 -175.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.8 m -76.68 138.14 39.83 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.64 -177.356 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 16.6 mt -126.89 174.56 8.72 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.222 -175.49 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.457 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -134.78 161.24 35.73 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.35 178.392 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.786 HD11 HD12 ' A' ' 50' ' ' ILE . 4.2 pp -151.43 158.68 44.0 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 179.127 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.648 ' HD2' ' N ' ' A' ' 62' ' ' ARG . 6.3 mpt_? -109.32 176.35 5.12 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 -175.639 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -61.73 -38.27 87.28 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.032 178.359 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.449 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 55.0 tptt -64.53 -49.3 71.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.278 176.322 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -61.88 -39.33 91.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.587 179.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 55.6 tp -63.33 -37.82 88.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.817 178.148 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.66 -10.9 60.48 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.557 -178.213 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 64' ' ' LYS . 77.3 mt -87.07 -23.41 24.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.739 0.304 . . . . 0.0 111.05 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.573 HD11 HD13 ' A' ' 32' ' ' LEU . 95.7 mt -113.97 135.38 54.06 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.584 -178.64 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.9 m -90.4 115.85 27.89 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 174.206 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 80.2 mt -110.85 133.48 53.33 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.951 -175.385 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.3 m -114.55 114.87 44.71 Favored Pre-proline 0 C--N 1.319 -0.728 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.369 172.439 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.585 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 39.6 Cg_endo -68.31 163.0 38.05 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 121.988 1.792 . . . . 0.0 112.087 -177.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.573 HD12 ' HB3' ' A' ' 9' ' ' SER . 80.0 mt -76.28 1.76 15.17 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.412 175.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 32.5 t70 . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.408 -0.806 . . . . 0.0 109.808 178.131 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.2 mpt? . . . . . 0 N--CA 1.483 1.189 0 CA-C-O 120.455 0.169 . . . . 0.0 110.82 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.2 m 67.01 34.06 5.37 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.627 0.727 . . . . 0.0 109.542 -171.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -121.17 125.77 48.01 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.349 -0.842 . . . . 0.0 110.54 -178.056 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.649 ' HA ' ' HD2' ' A' ' 42' ' ' ARG . 1.2 pp -150.46 -178.84 6.77 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.359 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.474 ' O ' ' HA ' ' A' ' 42' ' ' ARG . 36.3 tt0 -151.1 84.5 5.3 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-O 120.857 0.36 . . . . 0.0 110.131 -178.08 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.422 ' HD3' HD13 ' A' ' 4' ' ' LEU . 92.2 Cg_endo -90.52 171.88 3.47 Favored 'Trans proline' 0 N--CA 1.452 -0.93 0 C-N-CA 122.951 2.434 . . . . 0.0 112.212 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 18.9 t -156.5 -85.39 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.58 177.752 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.408 ' O ' HG12 ' A' ' 40' ' ' VAL . 86.8 mtt-85 -143.99 -174.91 4.4 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 121.108 0.48 . . . . 0.0 111.178 -172.87 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.466 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 17.8 m -101.44 144.97 29.58 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.083 -178.194 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.766 ' HE2' ' HB ' ' A' ' 40' ' ' VAL . 39.1 m-85 -121.61 128.13 51.61 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 177.307 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.493 ' HG2' ' HB2' ' A' ' 37' ' ' ALA . 98.3 mtt180 -90.25 155.81 18.74 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.569 -0.452 . . . . 0.0 110.584 178.349 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.7 mt -105.77 111.47 35.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.829 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 3.0 p -81.14 -21.3 39.91 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.896 0.379 . . . . 0.0 110.822 179.311 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.54 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 159.51 -144.49 10.23 Favored Glycine 0 N--CA 1.439 -1.11 0 C-N-CA 120.109 -1.044 . . . . 0.0 112.134 177.331 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.474 ' CB ' HG21 ' A' ' 19' ' ' ILE . 21.3 m-85 -123.96 157.82 33.47 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -177.659 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.487 ' O ' HG22 ' A' ' 19' ' ' ILE . 20.4 m -59.49 134.98 88.86 Favored Pre-proline 0 N--CA 1.447 -0.592 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 172.202 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 85.6 Cg_exo -48.05 -29.78 12.87 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 123.723 2.949 . . . . 0.0 114.736 -173.149 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -88.18 10.51 19.18 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -174.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.487 HG22 ' O ' ' A' ' 16' ' ' SER . 17.2 tt -77.71 114.74 18.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.492 0.663 . . . . 0.0 109.991 176.544 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.53 ' O ' ' HB2' ' A' ' 21' ' ' ASN . 65.4 m -165.83 99.17 0.66 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.825 -172.599 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.53 ' HB2' ' O ' ' A' ' 20' ' ' SER . 3.7 t30 171.37 33.27 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 177.64 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 73.47 -1.15 45.2 Favored Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.149 -173.08 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -60.55 -32.26 71.34 Favored 'General case' 0 C--N 1.334 -0.075 0 CA-C-O 120.774 0.321 . . . . 0.0 111.066 -175.578 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 11.8 mtp180 -62.27 -41.87 98.84 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.723 176.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -67.76 -34.69 77.31 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 120.963 0.411 . . . . 0.0 110.301 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.462 ' HA ' ' HD2' ' A' ' 26' ' ' ARG . 16.5 tpt180 -64.26 -42.91 96.25 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.771 -0.65 . . . . 0.0 109.978 176.028 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.637 HD13 HD21 ' A' ' 69' ' ' LEU . 90.6 mt -70.36 -38.08 74.71 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.504 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -59.53 -40.51 87.41 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.792 175.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 50.3 m -67.85 -33.23 74.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.838 179.336 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.544 ' HA ' ' CE ' ' A' ' 30' ' ' MET . 10.6 mmt -73.7 -23.17 59.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.868 178.39 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 109.28 12.67 19.29 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.894 -0.669 . . . . 0.0 112.343 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.4 mt -101.32 95.51 6.56 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.888 0.375 . . . . 0.0 110.325 -179.111 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.405 ' H ' HD23 ' A' ' 33' ' ' LEU . 1.9 pt? -130.88 154.74 82.02 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.288 -177.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.54 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 27.9 Cg_exo -61.48 119.49 6.66 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.722 2.281 . . . . 0.0 111.713 178.041 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.75 -7.12 17.68 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.773 -0.727 . . . . 0.0 111.996 -177.351 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -94.33 -171.96 2.66 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 120.984 0.421 . . . . 0.0 110.192 178.669 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.493 ' HB2' ' HG2' ' A' ' 11' ' ' ARG . . . -155.22 148.13 24.51 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.714 -177.014 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.571 HD13 HG21 ' A' ' 52' ' ' VAL . 33.0 mt -125.52 132.63 52.58 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 178.595 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 42.9 ttp180 -98.27 124.23 42.78 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 178.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.766 ' HB ' ' HE2' ' A' ' 10' ' ' TYR . 8.1 p -69.1 126.09 28.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.344 0.592 . . . . 0.0 111.416 -174.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 65.2 t -97.44 -44.58 12.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.353 177.141 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.649 ' HD2' ' HA ' ' A' ' 4' ' ' LEU . 78.8 ttt180 -165.41 135.55 3.64 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.868 0.366 . . . . 0.0 111.551 176.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.7 mp -90.77 129.33 41.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 172.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.436 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -64.62 131.45 95.12 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-O 120.656 0.265 . . . . 0.0 110.385 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 44.5 Cg_exo -58.31 -18.6 38.77 Favored 'Trans proline' 0 CA--C 1.532 0.404 0 C-N-CA 123.236 2.624 . . . . 0.0 113.093 -177.258 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -88.42 -20.46 25.22 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.334 -177.565 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 101.29 -13.56 58.48 Favored Glycine 0 C--O 1.235 0.177 0 N-CA-C 111.212 -0.755 . . . . 0.0 111.212 -173.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.583 ' CB ' ' HD2' ' A' ' 49' ' ' PRO . 0.5 OUTLIER -62.72 169.21 3.48 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 114.986 -0.607 . . . . 0.0 110.522 172.706 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.583 ' HD2' ' CB ' ' A' ' 48' ' ' ASP . 12.0 Cg_exo -29.07 151.68 0.01 OUTLIER 'Trans proline' 0 C--N 1.361 1.217 1 C-N-CA 125.335 4.024 . . . . 0.0 116.059 -170.786 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.504 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 60.0 mt -110.83 133.72 55.41 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 113.87 -1.514 . . . . 0.0 109.734 -173.08 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 -84.83 118.87 24.74 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.304 -179.261 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.571 HG21 HD13 ' A' ' 38' ' ' LEU . 27.6 m -128.92 167.12 24.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.1 178.337 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -129.29 151.0 50.42 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 -177.748 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 18.4 p -119.46 -64.28 1.29 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.627 -179.139 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.426 HH11 ' HD3' ' A' ' 55' ' ' ARG . 38.7 ttp180 -168.62 18.45 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.57 -176.677 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -148.29 -51.28 0.17 Allowed 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -172.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.4 t -173.02 167.2 5.01 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 -175.199 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.424 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 1.8 p -81.76 126.35 31.72 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.293 0.568 . . . . 0.0 111.417 -176.425 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 53.0 tp -118.87 147.22 44.2 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.79 -178.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.566 ' HB1' ' HB2' ' A' ' 49' ' ' PRO . . . -110.93 127.14 55.38 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.752 0.311 . . . . 0.0 110.602 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.7 pp -103.59 132.78 49.55 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.709 ' HD3' ' OD2' ' A' ' 65' ' ' ASP . 0.5 OUTLIER -75.49 174.45 9.63 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.069 0.461 . . . . 0.0 111.136 -170.715 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 23.0 mmm180 -62.19 -33.55 74.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.177 174.23 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -62.14 -52.75 62.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.841 177.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.709 ' OD2' ' HD3' ' A' ' 62' ' ' ARG . 33.4 m-20 -63.01 -41.99 99.7 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.087 -179.198 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 54.1 tp -60.18 -38.49 83.39 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.799 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.31 -15.76 62.42 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.953 0.406 . . . . 0.0 111.404 -179.121 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 94.4 mt -108.25 -4.32 17.65 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.383 -179.353 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.637 HD21 HD13 ' A' ' 27' ' ' LEU . 82.7 mt -110.67 134.82 52.11 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.778 0.323 . . . . 0.0 110.95 -179.355 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 32.2 m -106.58 116.9 32.73 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.213 0.53 . . . . 0.0 110.287 174.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.8 mp -124.62 150.49 45.96 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.696 -177.266 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 16.9 m -130.33 123.21 20.42 Favored Pre-proline 0 C--N 1.319 -0.731 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 175.052 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.46 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 36.2 Cg_endo -66.48 164.15 29.74 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.031 1.821 . . . . 0.0 111.601 179.032 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 9' ' ' SER . 91.1 mt -54.59 -40.88 69.27 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.796 172.35 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 22.8 t70 . . . . . 0 C--O 1.248 0.984 0 O-C-N 124.065 0.853 . . . . 0.0 110.843 173.864 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.067 0 CA-C-O 120.906 0.384 . . . . 0.0 110.65 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.4 m -82.79 76.74 9.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.098 0.475 . . . . 0.0 111.603 -177.587 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.665 ' HB3' HH21 ' A' ' 42' ' ' ARG . . . -102.13 82.46 2.22 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.426 0.631 . . . . 0.0 109.365 174.228 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 64.0 tp -103.01 118.35 36.61 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.304 -173.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -144.57 94.06 5.64 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.781 173.058 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.401 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 15.3 Cg_exo -68.65 133.42 27.62 Favored 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 122.647 2.231 . . . . 0.0 111.521 178.552 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.42 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 22.7 t -93.32 -82.9 0.33 Allowed 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.915 -0.314 . . . . 0.0 110.159 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 53.2 mtt180 -129.52 -176.29 3.85 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 121.033 0.444 . . . . 0.0 110.733 -179.055 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.425 ' HB2' HD12 ' A' ' 74' ' ' LEU . 16.1 m -124.11 138.77 54.39 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.58 -178.565 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.439 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 52.3 m-85 -122.24 133.05 54.71 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.617 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.584 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 8.0 ptp180 -100.5 157.62 16.51 Favored 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 119.998 -0.681 . . . . 0.0 110.261 175.551 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.433 HG12 ' CD2' ' A' ' 71' ' ' LEU . 22.2 mt -100.64 116.35 43.94 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.944 -179.784 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 1.4 m -92.22 -19.75 21.89 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.882 -177.53 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 164.79 -149.41 16.12 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.424 -179.28 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.459 ' HB3' HG21 ' A' ' 19' ' ' ILE . 72.5 m-85 -121.97 152.63 39.5 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.828 0.347 . . . . 0.0 110.821 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.737 ' O ' HG22 ' A' ' 19' ' ' ILE . 49.4 m -82.24 153.25 68.85 Favored Pre-proline 0 N--CA 1.448 -0.542 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.887 -179.53 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -62.38 -16.26 50.48 Favored 'Trans proline' 0 CA--C 1.532 0.395 0 C-N-CA 122.693 2.262 . . . . 0.0 113.218 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -83.92 -7.18 59.49 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -177.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.737 HG22 ' O ' ' A' ' 16' ' ' SER . 10.4 tt -92.88 147.7 5.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 C-N-CA 120.556 -0.458 . . . . 0.0 110.719 -179.409 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.3 t -84.98 158.1 20.6 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.635 -0.505 . . . . 0.0 109.635 178.509 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.493 ' O ' ' HB3' ' A' ' 24' ' ' ARG . 26.8 t-20 -63.5 -47.48 81.54 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.649 0.261 . . . . 0.0 111.373 -174.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.73 -38.33 95.48 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.433 -0.889 . . . . 0.0 112.208 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -64.53 -39.89 94.6 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 177.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.493 ' HB3' ' O ' ' A' ' 21' ' ' ASN . 15.9 ttm180 -56.2 -45.22 79.92 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.376 172.76 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -68.91 -31.57 70.58 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.224 -178.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.466 ' O ' ' HG3' ' A' ' 30' ' ' MET . 4.0 tmm_? -68.71 -39.68 80.32 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 175.509 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.452 HD22 HD12 ' A' ' 32' ' ' LEU . 40.2 mt -68.18 -40.5 82.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.332 0.587 . . . . 0.0 110.317 176.786 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -55.57 -48.02 75.47 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.079 174.255 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 47.8 m -60.07 -33.89 72.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.15 178.686 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.466 ' HG3' ' O ' ' A' ' 26' ' ' ARG . 90.1 mtp -70.47 -27.33 64.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.898 178.649 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.77 8.07 11.22 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.356 -178.585 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.472 HD13 HD11 ' A' ' 69' ' ' LEU . 76.4 mt -99.69 94.03 6.14 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.009 0.433 . . . . 0.0 110.09 -179.388 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.515 ' HB2' ' HD2' ' A' ' 34' ' ' PRO . 1.7 pt? -140.31 161.83 53.03 Favored Pre-proline 0 N--CA 1.447 -0.596 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.496 -178.588 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.515 ' HD2' ' HB2' ' A' ' 33' ' ' LEU . 18.7 Cg_endo -59.74 128.46 27.01 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.867 2.378 . . . . 0.0 111.77 175.774 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 111.62 4.05 26.76 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.128 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -113.82 172.83 6.75 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 120.982 0.42 . . . . 0.0 110.132 178.201 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.584 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -152.89 139.66 18.95 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.412 -178.05 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.668 HD13 HG21 ' A' ' 52' ' ' VAL . 50.5 mt -127.16 136.72 52.47 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.193 -178.113 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 16.3 ttm180 -99.67 131.06 45.9 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 174.028 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.597 HG21 HD11 ' A' ' 43' ' ' ILE . 9.0 p -72.55 135.08 28.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.342 0.591 . . . . 0.0 111.695 -172.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 75.4 t -106.54 -47.34 8.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.643 176.331 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.665 HH21 ' HB3' ' A' ' 3' ' ' ALA . 79.0 mtt180 -157.64 138.91 13.57 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -172.533 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.597 HD11 HG21 ' A' ' 40' ' ' VAL . 4.5 mp -130.0 119.87 48.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 163.39 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.718 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -67.62 138.19 93.41 Favored Pre-proline 0 C--N 1.322 -0.607 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.125 -176.918 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -58.88 -19.17 45.99 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 123.618 2.879 . . . . 0.0 112.924 -178.463 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -55.96 -39.62 72.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.723 0.773 . . . . 0.0 110.727 176.083 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 162.16 -74.52 0.19 Allowed Glycine 0 CA--C 1.494 -1.23 0 N-CA-C 110.509 -1.036 . . . . 0.0 110.509 -175.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.635 ' OD1' HG13 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -163.23 120.72 1.23 Allowed Pre-proline 0 N--CA 1.436 -1.132 0 N-CA-C 115.543 1.683 . . . . 0.0 115.543 176.897 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.718 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 31.3 Cg_endo -116.33 155.08 0.03 OUTLIER 'Trans proline' 0 N--CA 1.437 -1.798 1 C-N-CA 125.348 4.032 . . . . 0.0 108.439 123.614 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.94 HD13 HD22 ' A' ' 66' ' ' LEU . 96.0 mt -118.45 103.81 15.18 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.721 0 C-N-CA 119.209 -0.997 . . . . 0.0 110.938 -177.535 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.706 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 36.0 mt-30 -92.9 123.31 36.07 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.979 177.199 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.668 HG21 HD13 ' A' ' 38' ' ' LEU . 27.1 m -139.68 170.3 15.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.164 -177.653 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -116.9 135.48 53.69 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.1 m -110.29 -41.24 4.45 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.673 -172.004 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.7 ttm180 -176.72 -37.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.747 -173.608 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -120.93 -53.44 2.06 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.879 0.371 . . . . 0.0 110.638 -174.464 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.6 t -142.31 175.07 10.05 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 -174.32 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.497 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 13.9 m -88.53 134.05 33.98 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-O 121.318 0.58 . . . . 0.0 110.624 -178.725 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.706 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 3.1 mm? -112.02 173.72 6.22 Favored 'General case' 0 C--N 1.317 -0.848 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.178 179.486 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.595 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -142.19 144.4 33.39 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.088 -178.416 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -154.36 -175.34 5.35 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 -178.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.415 ' HA ' ' HD3' ' A' ' 62' ' ' ARG . 19.6 mmt180 -107.42 160.27 15.76 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 122.208 1.004 . . . . 0.0 112.792 -178.445 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -56.0 -41.44 74.87 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 113.008 -1.905 . . . . 0.0 112.094 -179.544 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.552 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 42.8 tttp -66.97 -43.11 83.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.714 0.292 . . . . 0.0 110.489 -176.152 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -59.71 -40.68 88.75 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.145 177.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.94 HD22 HD13 ' A' ' 50' ' ' ILE . 10.4 tp -70.48 -39.02 74.48 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.632 179.566 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.74 -26.84 66.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.456 -179.208 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.632 ' HB3' ' HB ' ' A' ' 19' ' ' ILE . 94.6 mt -77.51 -7.65 56.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.983 0.421 . . . . 0.0 110.564 177.564 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.472 HD11 HD13 ' A' ' 32' ' ' LEU . 68.5 mt -99.02 140.91 32.47 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.662 174.342 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 28.7 m -85.74 114.05 22.4 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 172.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.567 HD11 ' HG ' ' A' ' 66' ' ' LEU . 68.9 mt -120.3 139.12 53.2 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.626 -174.332 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.418 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 28.5 m -127.0 129.52 23.97 Favored Pre-proline 0 C--N 1.318 -0.799 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.496 170.054 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.439 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 3.3 Cg_exo -75.65 162.43 35.46 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 122.108 1.872 . . . . 0.0 111.736 -179.289 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.425 HD12 ' HB2' ' A' ' 9' ' ' SER . 60.7 mt -69.78 -34.62 74.01 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.204 172.55 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 37.1 t70 . . . . . 0 C--O 1.25 1.121 0 CA-C-O 118.611 -0.709 . . . . 0.0 109.834 177.906 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.1 mtt . . . . . 0 N--CA 1.482 1.134 0 CA-C-O 120.611 0.243 . . . . 0.0 110.535 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.1 m -76.15 91.24 3.14 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.042 0.449 . . . . 0.0 111.633 -177.28 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -112.78 39.09 2.6 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.638 0.732 . . . . 0.0 109.173 173.815 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.559 HD22 HG12 ' A' ' 41' ' ' VAL . 61.1 mt -102.29 141.33 35.29 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.113 -173.356 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -155.19 93.96 2.66 Favored Pre-proline 0 C--N 1.325 -0.479 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.116 175.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.604 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 25.4 Cg_exo -63.36 139.3 70.57 Favored 'Trans proline' 0 N--CA 1.464 -0.231 0 C-N-CA 123.056 2.504 . . . . 0.0 112.43 -179.531 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 48.0 t -126.9 -80.07 0.6 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.104 -179.318 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.408 ' H ' HG12 ' A' ' 40' ' ' VAL . 42.2 mtp85 -115.45 152.85 32.17 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.12 0.486 . . . . 0.0 111.475 -175.469 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.472 ' HB2' HD11 ' A' ' 74' ' ' LEU . 7.8 m -117.12 143.87 45.32 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.062 177.929 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 93.9 m-85 -128.89 140.03 51.87 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.813 0.339 . . . . 0.0 110.863 -175.655 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.61 ' HD3' ' HB2' ' A' ' 37' ' ' ALA . 28.7 mmt180 -83.75 150.91 25.51 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.829 175.21 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.597 HG12 ' CD2' ' A' ' 71' ' ' LEU . 46.0 mt -103.06 113.07 38.76 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 169.425 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 6.7 p -90.32 -11.68 40.01 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.06 0.457 . . . . 0.0 111.092 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 161.2 -158.33 30.0 Favored Glycine 0 N--CA 1.442 -0.955 0 C-N-CA 120.293 -0.956 . . . . 0.0 112.175 177.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 48.2 m-85 -114.99 150.17 36.23 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 -179.433 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.419 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 53.0 m -72.22 137.89 81.56 Favored Pre-proline 0 C--N 1.316 -0.884 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.424 -179.416 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 62.9 Cg_exo -52.88 156.3 9.63 Favored 'Trans proline' 0 C--O 1.237 0.474 0 C-N-CA 122.941 2.427 . . . . 0.0 112.548 178.396 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 17' ' ' PRO . . . 75.01 12.9 3.39 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.289 -177.143 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 16.0 tt -83.94 146.71 6.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.192 176.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.9 t -74.44 140.31 44.56 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 178.497 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -62.06 -49.83 74.4 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.917 -177.478 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.45 -31.27 80.32 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.976 -0.631 . . . . 0.0 112.359 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.446 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 21.5 t80 -72.59 -37.46 68.14 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.433 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.8 ttm180 -59.14 -43.0 91.99 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.759 172.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -66.04 -39.18 89.94 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.386 177.677 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.434 HH11 ' HD3' ' A' ' 26' ' ' ARG . 5.1 tpt180 -63.44 -39.31 94.14 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.019 178.268 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 23' ' ' TYR . 95.5 mt -66.58 -45.01 80.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.805 177.411 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -55.89 -47.77 76.82 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.3 176.848 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 50.3 m -60.93 -35.31 76.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.135 179.611 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 71.9 mtm -78.96 -14.98 58.89 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.75 -178.137 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 114.28 6.21 20.41 Favored Glycine 0 N--CA 1.453 -0.209 0 C-N-CA 120.331 -0.938 . . . . 0.0 113.026 175.676 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.665 HD13 HD11 ' A' ' 69' ' ' LEU . 82.6 mt -99.87 87.04 3.41 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 178.634 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.416 ' HB2' ' HD2' ' A' ' 34' ' ' PRO . 1.8 pt? -129.99 157.64 76.33 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.757 -177.186 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.416 ' HD2' ' HB2' ' A' ' 33' ' ' LEU . 18.0 Cg_endo -61.06 123.75 13.51 Favored 'Trans proline' 0 C--O 1.235 0.341 0 C-N-CA 122.534 2.156 . . . . 0.0 111.577 177.05 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 111.9 -17.43 24.98 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 121.04 -0.6 . . . . 0.0 111.856 -176.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -91.84 111.44 22.97 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.068 0.461 . . . . 0.0 110.234 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.61 ' HB2' ' HD3' ' A' ' 11' ' ' ARG . . . -90.37 129.06 36.62 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.828 177.353 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.417 ' N ' HD22 ' A' ' 38' ' ' LEU . 2.8 mm? -104.31 143.54 32.84 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.561 178.367 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 39' ' ' ARG . 36.1 ttm180 -105.21 124.62 49.85 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.339 176.482 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.604 ' O ' ' HA ' ' A' ' 6' ' ' PRO . 5.8 p -66.87 125.88 25.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.18 0.515 . . . . 0.0 110.377 -178.572 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.559 HG12 HD22 ' A' ' 4' ' ' LEU . 21.2 t -104.97 -39.46 5.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.543 -178.475 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 19.6 ttm180 -158.1 121.71 4.01 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 121.095 -0.242 . . . . 0.0 110.887 179.331 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.489 ' HA ' HG23 ' A' ' 50' ' ' ILE . 4.2 mp -97.42 130.37 46.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 178.514 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.461 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -75.58 134.69 72.5 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 174.824 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 24.7 Cg_exo -64.16 -4.34 7.58 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 123.113 2.542 . . . . 0.0 113.425 -174.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 7.0 mp -93.36 -20.83 19.97 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.663 0.268 . . . . 0.0 111.113 -179.151 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.62 -16.93 60.25 Favored Glycine 0 N--CA 1.453 -0.231 0 N-CA-C 110.774 -0.93 . . . . 0.0 110.774 -172.628 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.755 ' HB3' ' HD2' ' A' ' 49' ' ' PRO . 0.4 OUTLIER -69.43 170.05 10.39 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 114.72 -0.74 . . . . 0.0 109.594 171.726 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.827 ' HD3' ' HD3' ' A' ' 62' ' ' ARG . 5.6 Cg_exo -32.37 150.0 0.02 OUTLIER 'Trans proline' 0 C--N 1.361 1.209 0 C-N-CA 124.849 3.699 . . . . 0.0 116.718 -155.791 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.489 HG23 ' HA ' ' A' ' 43' ' ' ILE . 69.1 mt -124.07 134.22 67.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-N 113.684 -1.598 . . . . 0.0 109.634 -173.642 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.448 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 2.3 mp0 -78.76 120.69 23.76 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 177.686 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.457 ' O ' ' HA ' ' A' ' 58' ' ' SER . 27.3 m -128.4 160.01 39.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.666 -178.009 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -112.37 130.82 55.83 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.715 -173.213 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.5 t -104.09 -34.44 8.41 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.979 176.414 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 34.1 mtp180 -153.34 -89.35 0.05 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.526 177.687 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -112.89 0.79 15.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.484 -178.084 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.5 t -133.0 154.7 50.27 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.878 -177.422 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.457 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 7.2 m -104.92 139.21 39.97 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.663 -178.836 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.448 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 7.4 mp -118.0 173.23 6.89 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.942 178.0 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -142.52 141.78 32.13 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.667 0.27 . . . . 0.0 110.766 -179.53 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.476 ' O ' ' HA ' ' A' ' 49' ' ' PRO . 3.3 pp -143.97 150.99 39.16 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 178.638 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.827 ' HD3' ' HD3' ' A' ' 49' ' ' PRO . 32.1 mmt180 -73.77 174.16 8.82 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 121.382 0.611 . . . . 0.0 111.173 -176.761 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 63' ' ' ARG . 16.9 ptt180 -70.35 -33.7 71.77 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.895 179.464 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.445 ' HD2' ' C ' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -57.41 -47.4 81.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.074 174.14 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -68.28 -37.7 80.93 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.955 -177.776 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 38.8 tp -59.31 -38.94 81.54 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.842 177.372 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.93 -25.63 63.75 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.153 -178.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 82.0 mt -83.91 -8.6 59.14 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.23 -177.774 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.665 HD11 HD13 ' A' ' 32' ' ' LEU . 96.9 mt -103.86 132.7 49.86 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 110.251 -0.277 . . . . 0.0 110.251 178.036 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.0 m -89.43 114.18 25.62 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 175.225 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.597 ' CD2' HG12 ' A' ' 12' ' ' ILE . 73.6 mt -118.71 132.21 56.15 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.001 -173.391 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 27.2 m -122.06 132.77 24.19 Favored Pre-proline 0 C--N 1.318 -0.804 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.625 173.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -69.45 163.41 38.11 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 121.84 1.693 . . . . 0.0 112.426 -176.676 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.472 HD11 ' HB2' ' A' ' 9' ' ' SER . 85.9 mt -67.04 -14.97 63.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.732 173.116 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.6 t0 . . . . . 0 C--O 1.252 1.204 0 O-C-N 124.165 0.916 . . . . 0.0 110.318 -178.231 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.482 1.128 0 CA-C-O 121.024 0.44 . . . . 0.0 109.827 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.5 t -104.07 110.37 22.52 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 177.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -95.95 99.18 10.99 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.297 -178.009 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.614 ' HG ' HG13 ' A' ' 41' ' ' VAL . 6.4 mp -97.48 122.41 40.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.189 -0.459 . . . . 0.0 109.811 175.785 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -122.29 85.02 47.0 Favored Pre-proline 0 C--N 1.32 -0.674 0 N-CA-C 109.408 -0.589 . . . . 0.0 109.408 177.294 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.536 ' HA ' HG13 ' A' ' 40' ' ' VAL . 40.5 Cg_endo -69.27 105.36 1.39 Allowed 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 122.274 1.983 . . . . 0.0 112.861 -176.367 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.9 t -82.99 -54.67 4.89 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.172 176.156 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 -155.79 144.77 20.58 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 176.043 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.533 ' HB2' HD11 ' A' ' 74' ' ' LEU . 15.1 m -90.94 140.7 29.58 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 -179.598 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -124.27 142.22 51.43 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.843 0.354 . . . . 0.0 110.7 -175.656 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.597 ' HG3' HD23 ' A' ' 74' ' ' LEU . 90.6 mtt-85 -99.05 157.25 16.47 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.717 175.422 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 49.7 mt -94.07 112.99 27.85 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.739 179.006 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.96 -33.35 70.38 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.434 0.635 . . . . 0.0 110.156 178.154 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.555 ' HA2' ' HB3' ' A' ' 34' ' ' PRO . . . 153.94 -147.36 16.59 Favored Glycine 0 N--CA 1.444 -0.807 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.329 -179.655 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -113.61 160.56 18.43 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 -179.426 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.441 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 34.0 t -62.8 133.01 94.96 Favored Pre-proline 0 C--N 1.321 -0.665 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 172.588 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 31.7 Cg_exo -60.1 -16.53 40.2 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.895 2.396 . . . . 0.0 112.727 -178.683 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -103.6 24.33 11.3 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.081 -178.094 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 18.4 tt -71.2 155.01 7.67 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 175.564 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.1 p -124.24 127.15 47.26 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -172.113 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.417 ' HB3' ' H ' ' A' ' 22' ' ' GLY . 16.7 m120 64.94 -156.32 0.29 Allowed 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.222 -0.899 . . . . 0.0 112.478 168.615 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.417 ' H ' ' HB3' ' A' ' 21' ' ' ASN . . . -75.14 15.09 4.39 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 115.337 -0.847 . . . . 0.0 113.356 -175.856 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.406 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 29.1 t80 -61.95 -36.09 80.38 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 174.909 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 4.4 tmm_? -64.62 -39.77 94.29 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.373 175.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -68.58 -35.31 77.2 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.246 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -64.4 -41.44 96.64 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.691 176.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.825 HD13 HD21 ' A' ' 69' ' ' LEU . 83.7 mt -67.17 -43.66 81.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.186 177.231 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -59.5 -44.58 93.05 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.502 178.677 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.3 m -64.24 -33.77 76.58 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.886 179.144 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 70.4 mtm -78.12 -16.47 57.93 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.327 -178.163 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 112.78 11.87 13.7 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.427 -0.892 . . . . 0.0 113.013 174.774 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 94.4 mt -100.63 95.9 7.0 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.794 0.331 . . . . 0.0 110.321 179.447 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -132.52 152.81 80.66 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.686 -179.508 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.555 ' HB3' ' HA2' ' A' ' 14' ' ' GLY . 24.0 Cg_endo -62.4 139.14 75.22 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.855 2.37 . . . . 0.0 112.132 179.11 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 107.36 -26.33 18.84 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.298 178.671 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.07 -172.47 4.15 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 121.141 0.496 . . . . 0.0 110.212 -178.51 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.563 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -145.28 144.06 30.55 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.066 -176.606 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.419 HD13 HG21 ' A' ' 52' ' ' VAL . 84.1 mt -118.47 137.82 52.92 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.687 178.013 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 40.2 ttt85 -101.71 117.62 35.25 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.546 ' HA ' HG12 ' A' ' 52' ' ' VAL . 14.5 p -62.48 127.1 21.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.66 0.743 . . . . 0.0 111.707 -176.253 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.614 HG13 ' HG ' ' A' ' 4' ' ' LEU . 91.6 t -90.4 -61.26 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.969 170.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 50.1 mtp180 -167.13 155.43 9.69 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 123.72 0.638 . . . . 0.0 111.597 -177.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.485 HG23 ' HD2' ' A' ' 49' ' ' PRO . 3.3 mp -117.15 116.7 52.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 163.565 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -54.13 135.02 59.29 Favored Pre-proline 0 C--N 1.326 -0.416 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -67.86 -1.58 7.12 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.812 2.341 . . . . 0.0 112.141 179.133 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.42 HD13 ' HA ' ' A' ' 46' ' ' LEU . 3.9 mm? -63.8 -28.8 70.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.577 174.268 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 157.46 -76.59 0.2 Allowed Glycine 0 N--CA 1.438 -1.181 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.939 -176.408 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -167.78 120.01 0.72 Allowed Pre-proline 0 N--CA 1.448 -0.543 0 N-CA-C 113.882 1.067 . . . . 0.0 113.882 176.567 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.485 ' HD2' HG23 ' A' ' 43' ' ' ILE . 81.1 Cg_endo -118.67 -168.72 0.02 OUTLIER 'Trans proline' 0 N--CA 1.433 -2.055 1 C-N-CA 126.372 4.715 . . . . 0.0 108.243 140.318 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.741 HD12 HD11 ' A' ' 61' ' ' LEU . 62.6 mt -140.67 100.62 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 168.869 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.439 ' OE1' ' HB2' ' A' ' 60' ' ' ALA . 5.3 tp60 -86.93 116.52 25.04 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 178.478 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.546 HG12 ' HA ' ' A' ' 40' ' ' VAL . 11.5 m -136.79 175.97 8.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.528 0.204 . . . . 0.0 110.56 -177.851 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.44 ' HG2' ' H ' ' A' ' 55' ' ' ARG . 40.8 tt0 -147.17 138.88 24.19 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 176.065 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -86.16 27.23 0.93 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.093 0.473 . . . . 0.0 109.912 176.745 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.44 ' H ' ' HG2' ' A' ' 53' ' ' GLU . 43.3 ttm105 67.1 16.01 10.19 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 121.904 0.859 . . . . 0.0 109.923 -175.833 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -139.42 -70.55 0.4 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.382 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 17.0 m -114.61 141.65 47.5 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.046 177.794 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 23.1 p -85.32 146.98 26.76 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.954 0.407 . . . . 0.0 110.491 176.804 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 15.9 mt -141.19 167.35 22.38 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.639 -179.131 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.499 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -137.93 154.77 49.38 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 114.678 -1.146 . . . . 0.0 109.873 -179.385 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.741 HD11 HD12 ' A' ' 50' ' ' ILE . 1.3 pp -157.31 168.3 27.78 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 -179.785 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.648 ' HD3' ' OD2' ' A' ' 65' ' ' ASP . 0.1 OUTLIER -107.63 172.49 6.8 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.042 0.449 . . . . 0.0 110.329 -176.899 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.504 ' HG3' ' N ' ' A' ' 64' ' ' LYS . 0.2 OUTLIER -59.97 -34.03 72.74 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.549 174.258 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.504 ' N ' ' HG3' ' A' ' 63' ' ' ARG . 1.5 tmtp? -62.5 -40.91 98.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.969 -1.014 . . . . 0.0 110.297 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.648 ' OD2' ' HD3' ' A' ' 62' ' ' ARG . 26.1 m-20 -72.94 -37.86 66.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.797 179.168 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 53.0 tp -61.27 -31.63 71.45 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.481 177.627 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.11 -10.9 60.41 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.302 178.695 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 95.9 mt -110.59 -5.29 15.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.962 0.411 . . . . 0.0 110.815 179.416 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.825 HD21 HD13 ' A' ' 27' ' ' LEU . 98.7 mt -123.53 125.29 44.62 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.623 -177.67 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 6.7 m -91.53 114.25 26.73 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.009 0.433 . . . . 0.0 110.065 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 8.9 mp -125.65 143.61 50.96 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.466 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 15.6 m -137.23 159.15 70.82 Favored Pre-proline 0 C--N 1.32 -0.697 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.643 178.143 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -61.29 167.64 9.09 Favored 'Trans proline' 0 C--O 1.234 0.284 0 C-N-CA 122.206 1.938 . . . . 0.0 112.068 177.482 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.597 HD23 ' HG3' ' A' ' 11' ' ' ARG . 86.3 mt -54.42 -56.25 20.57 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.985 0.421 . . . . 0.0 110.383 176.441 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.6 t0 . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.259 -0.876 . . . . 0.0 109.287 177.858 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.5 mpp? . . . . . 0 N--CA 1.481 1.113 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.7 m 61.28 86.7 0.1 Allowed 'General case' 0 C--N 1.33 -0.272 0 O-C-N 123.759 0.662 . . . . 0.0 111.755 178.507 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -72.13 93.58 1.44 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.905 177.121 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 80.9 mt -109.71 106.87 16.69 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.055 -174.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 21.7 pt20 -122.61 88.09 49.63 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 116.022 -0.536 . . . . 0.0 109.923 176.427 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -71.01 150.26 60.31 Favored 'Trans proline' 0 N--CA 1.463 -0.288 0 C-N-CA 122.949 2.433 . . . . 0.0 112.154 -179.136 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 38.5 t -92.31 -74.11 0.53 Allowed 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 177.003 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.411 ' O ' HG12 ' A' ' 40' ' ' VAL . 87.9 mtt180 -133.68 179.67 6.09 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 121.384 0.612 . . . . 0.0 110.884 -179.08 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 37.3 m -124.59 129.64 50.95 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.085 176.211 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -113.99 149.18 35.72 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.917 0.389 . . . . 0.0 110.87 -174.262 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 78.7 mtp180 -105.46 153.24 21.98 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 174.75 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.662 HD12 ' HB3' ' A' ' 36' ' ' ALA . 35.2 mt -97.2 105.58 17.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 177.354 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.66 -31.45 71.46 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.4 0.619 . . . . 0.0 110.188 179.059 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 160.09 -153.49 24.46 Favored Glycine 0 N--CA 1.443 -0.89 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.311 -178.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 66.2 m-85 -99.38 162.39 13.07 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 179.467 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.7 t -69.63 132.67 89.05 Favored Pre-proline 0 C--N 1.317 -0.845 0 N-CA-C 109.103 -0.702 . . . . 0.0 109.103 172.23 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -63.33 -7.07 11.29 Favored 'Trans proline' 0 C--O 1.233 0.255 0 C-N-CA 122.595 2.197 . . . . 0.0 112.67 -178.138 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.37 1.71 56.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.287 178.713 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 14.7 tt -75.12 146.75 9.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 179.129 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.7 t -160.37 -178.95 7.28 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 121.166 -0.214 . . . . 0.0 110.451 -177.193 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.4 t30 70.78 7.4 6.2 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 123.731 0.812 . . . . 0.0 111.767 175.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.7 14.13 61.79 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.542 -0.837 . . . . 0.0 113.051 177.117 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -65.28 -24.16 67.23 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.002 0.429 . . . . 0.0 110.085 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.411 HH11 ' HD3' ' A' ' 24' ' ' ARG . 25.8 ttt180 -53.1 -48.66 67.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.578 173.566 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 83.5 mt-30 -64.98 -28.17 69.33 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.353 -179.576 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 26.5 tpt180 -74.33 -40.96 61.84 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.852 176.543 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.68 HD22 HD12 ' A' ' 32' ' ' LEU . 46.1 mt -66.91 -42.1 86.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.755 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -59.72 -43.15 94.29 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.923 177.081 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 70.1 m -63.15 -30.69 71.79 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.323 177.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 89.3 mtp -80.23 -16.18 55.34 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.218 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 108.98 10.82 23.76 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.479 -0.867 . . . . 0.0 112.647 176.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.903 HD13 HD11 ' A' ' 69' ' ' LEU . 84.8 mt -101.42 100.11 10.54 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.961 0.41 . . . . 0.0 109.925 179.374 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.408 ' H ' HD23 ' A' ' 33' ' ' LEU . 1.9 pt? -131.8 156.12 80.52 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.817 -177.463 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -64.69 125.44 14.88 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.719 2.28 . . . . 0.0 111.473 176.137 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 109.55 -1.07 30.73 Favored Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.652 -0.785 . . . . 0.0 112.838 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.662 ' HB3' HD12 ' A' ' 12' ' ' ILE . . . -88.4 -172.75 3.9 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 120.989 0.423 . . . . 0.0 110.046 178.807 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -158.13 146.88 19.09 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.455 -177.427 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.437 HD13 HG21 ' A' ' 52' ' ' VAL . 82.5 mt -137.74 139.85 40.35 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.925 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 52.5 ttm-85 -101.72 124.85 48.05 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 175.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.603 ' HA ' HG12 ' A' ' 52' ' ' VAL . 9.3 p -75.88 122.69 30.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.522 0.677 . . . . 0.0 110.622 -177.239 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.599 HG12 ' HG3' ' A' ' 42' ' ' ARG . 48.9 t -93.73 -52.9 9.13 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.36 178.279 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.599 ' HG3' HG12 ' A' ' 41' ' ' VAL . 96.5 mtt180 -152.74 140.39 19.86 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -174.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.453 HD11 HG21 ' A' ' 40' ' ' VAL . 4.5 mp -116.27 144.22 24.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 164.783 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.603 ' H ' ' CD ' ' A' ' 49' ' ' PRO . . . -81.94 138.36 46.42 Favored Pre-proline 0 C--N 1.318 -0.785 0 CA-C-N 117.788 0.267 . . . . 0.0 110.923 178.645 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -66.14 -5.31 12.07 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 123.24 2.626 . . . . 0.0 112.56 179.489 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -65.53 -35.89 82.2 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.206 174.587 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 158.65 -77.49 0.19 Allowed Glycine 0 N--CA 1.438 -1.226 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.037 -176.197 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -153.62 120.03 2.88 Favored Pre-proline 0 N--CA 1.445 -0.724 0 N-CA-C 114.501 1.297 . . . . 0.0 114.501 179.302 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.603 ' CD ' ' H ' ' A' ' 44' ' ' ALA . 94.6 Cg_endo -119.51 -173.51 0.02 OUTLIER 'Trans proline' 0 N--CA 1.436 -1.854 1 C-N-CA 126.482 4.788 . . . . 0.0 107.693 131.301 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.732 HG22 HG13 ' A' ' 52' ' ' VAL . 57.1 mt -142.1 100.85 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.425 0 C-N-CA 119.749 -0.78 . . . . 0.0 109.942 170.81 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.57 112.57 22.41 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 178.437 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.732 HG13 HG22 ' A' ' 50' ' ' ILE . 24.2 m -129.41 -177.12 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.831 0.348 . . . . 0.0 110.59 -177.058 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -133.74 132.1 40.18 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 174.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.4 m -76.79 -30.98 56.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.082 0.467 . . . . 0.0 110.931 -176.69 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.408 ' HD3' HH11 ' A' ' 55' ' ' ARG . 9.3 ptp180 173.72 -26.26 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.642 -178.406 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -155.25 -36.73 0.09 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.166 -179.845 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.7 t -96.88 141.73 29.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.416 -179.383 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 45.4 m -80.95 146.59 30.67 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.618 178.445 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.8 tp -138.62 159.92 40.9 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.296 -179.608 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.572 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -138.94 156.84 46.93 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.927 -0.398 . . . . 0.0 109.927 177.74 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.656 HD11 HD12 ' A' ' 50' ' ' ILE . 3.7 pp -161.94 168.8 22.28 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -178.119 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.648 ' HD3' ' OD2' ' A' ' 65' ' ' ASP . 0.0 OUTLIER -109.43 169.04 8.95 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.448 0.642 . . . . 0.0 111.293 -177.603 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.572 ' HD2' ' N ' ' A' ' 64' ' ' LYS . 2.0 ppt_? -58.35 -33.25 69.35 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.69 -1.141 . . . . 0.0 111.796 176.223 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.572 ' N ' ' HD2' ' A' ' 63' ' ' ARG . 88.6 tttt -63.96 -44.61 92.27 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.489 176.406 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.648 ' OD2' ' HD3' ' A' ' 62' ' ' ARG . 23.3 m-20 -65.94 -36.8 84.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.287 0.565 . . . . 0.0 109.596 177.757 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.3 tp -59.25 -35.68 74.12 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.621 175.375 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.87 -10.48 58.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.622 -178.272 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 78.5 mt -94.84 -13.85 25.15 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.958 0.409 . . . . 0.0 110.444 178.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.903 HD11 HD13 ' A' ' 32' ' ' LEU . 96.7 mt -115.03 150.08 36.44 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.071 0.462 . . . . 0.0 110.865 -177.615 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 22.6 m -108.51 118.89 37.95 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.368 -0.605 . . . . 0.0 109.368 170.686 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 77.9 mt -120.02 138.41 53.53 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.99 -174.602 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.427 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 19.7 m -130.73 134.42 25.99 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.659 174.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 72' ' ' VAL . 27.7 Cg_exo -62.07 164.59 16.55 Favored 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 122.283 1.989 . . . . 0.0 112.103 179.499 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 96.0 mt -53.25 -42.1 66.13 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.538 175.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 33.9 t70 . . . . . 0 C--O 1.247 0.962 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.77 177.607 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.0 ttm . . . . . 0 N--CA 1.479 1.006 0 CA-C-O 120.624 0.25 . . . . 0.0 110.907 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.0 m -78.3 108.59 11.74 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -174.028 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 70.34 151.87 0.1 Allowed 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.071 -0.968 . . . . 0.0 112.592 174.751 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 92.9 mt -136.32 152.27 50.49 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.122 175.678 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.4 pm0 -88.22 149.79 45.74 Favored Pre-proline 0 C--N 1.322 -0.589 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.814 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.66 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 18.0 Cg_endo -61.28 104.4 0.29 Allowed 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 121.914 1.742 . . . . 0.0 110.687 175.608 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 29.7 t -93.52 -76.73 0.47 Allowed 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.176 -171.053 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.413 ' HD2' ' HA ' ' A' ' 8' ' ' ARG . 0.5 OUTLIER -93.66 164.88 12.98 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.99 0.424 . . . . 0.0 110.487 -177.057 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.462 ' OG ' ' HG3' ' A' ' 39' ' ' ARG . 16.6 m -132.51 139.18 47.81 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.886 178.386 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.402 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 59.3 m-85 -120.4 133.44 55.43 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.116 -177.965 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.66 HH11 ' HB2' ' A' ' 37' ' ' ALA . 21.8 mmm180 -89.21 148.52 23.57 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 178.33 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.54 HG12 ' CD2' ' A' ' 71' ' ' LEU . 47.7 mt -102.42 113.06 37.87 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 175.364 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 4.5 p -81.21 -23.37 38.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.859 0.361 . . . . 0.0 110.904 179.472 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 161.75 -145.89 11.43 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 120.457 -0.878 . . . . 0.0 112.102 -178.469 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -117.99 154.55 31.78 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.161 0.505 . . . . 0.0 110.889 -175.72 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.435 ' O ' HG22 ' A' ' 19' ' ' ILE . 43.3 t -73.64 139.99 78.05 Favored Pre-proline 0 C--N 1.318 -0.782 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.319 174.148 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 31.3 Cg_exo -60.5 -8.73 9.43 Favored 'Trans proline' 0 N--CA 1.475 0.398 0 C-N-CA 123.152 2.568 . . . . 0.0 113.341 -178.814 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.63 -6.36 58.93 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.515 179.669 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.435 HG22 ' O ' ' A' ' 16' ' ' SER . 16.5 tt -79.23 139.47 18.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-O 120.909 0.385 . . . . 0.0 110.006 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.8 p -153.41 170.97 19.4 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -176.122 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 65.9 t30 67.62 38.01 3.17 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.578 172.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.94 21.04 75.12 Favored Glycine 0 N--CA 1.454 -0.136 0 C-N-CA 121.027 -0.606 . . . . 0.0 113.594 174.225 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.416 ' HB3' ' CG1' ' A' ' 19' ' ' ILE . 7.3 t80 -66.83 -22.83 65.99 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.829 0.347 . . . . 0.0 110.446 -177.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 32.1 mtp180 -64.52 -40.89 96.45 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.663 175.571 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -69.12 -35.52 76.5 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 120.989 0.423 . . . . 0.0 110.141 179.401 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -66.06 -42.18 89.78 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.872 177.61 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.566 HD22 HD12 ' A' ' 32' ' ' LEU . 61.2 mt -70.97 -34.95 71.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.537 -179.785 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -58.46 -44.32 89.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.35 176.405 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 49.3 m -61.44 -35.34 77.31 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.806 178.702 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 91.9 mtp -75.79 -36.34 59.78 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.51 -178.449 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.04 14.97 5.34 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.202 -178.265 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.566 HD12 HD22 ' A' ' 27' ' ' LEU . 94.5 mt -104.46 91.98 4.12 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.911 0.386 . . . . 0.0 110.25 179.375 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.491 ' HB2' ' HD2' ' A' ' 34' ' ' PRO . 1.7 pt? -137.83 160.54 64.35 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.392 -179.224 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.491 ' HD2' ' HB2' ' A' ' 33' ' ' LEU . 13.8 Cg_endo -57.44 129.99 36.78 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.797 2.331 . . . . 0.0 111.659 176.716 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 110.75 -17.27 27.93 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.227 -177.225 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.66 100.55 12.9 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.913 0.387 . . . . 0.0 110.714 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.66 ' HB2' HH11 ' A' ' 11' ' ' ARG . . . -75.8 134.55 40.37 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.906 177.421 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 34.7 mt -110.21 135.91 50.25 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.567 -178.744 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.565 ' HB2' ' HB3' ' A' ' 53' ' ' GLU . 0.3 OUTLIER -94.55 147.44 23.27 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 172.928 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.66 ' O ' ' HA ' ' A' ' 6' ' ' PRO . 11.8 p -85.15 124.11 39.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-O 120.831 0.348 . . . . 0.0 111.036 -176.318 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 96.0 t -102.63 -50.19 9.93 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 C-N-CA 120.776 -0.37 . . . . 0.0 110.678 173.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.401 ' HB2' ' HE ' ' A' ' 42' ' ' ARG . 2.1 ttm180 -177.12 158.04 1.46 Allowed 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -175.801 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.403 HG23 ' CB ' ' A' ' 48' ' ' ASP . 46.7 mm -129.85 141.7 45.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 170.657 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.504 ' HB2' ' CD ' ' A' ' 49' ' ' PRO . . . -65.63 152.54 92.51 Favored Pre-proline 0 N--CA 1.469 0.522 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -179.49 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -69.07 -32.1 22.17 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 122.728 2.285 . . . . 0.0 112.616 175.66 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.413 HD13 ' HA ' ' A' ' 46' ' ' LEU . 4.0 mm? -65.51 -88.58 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.809 0.814 . . . . 0.0 110.45 177.095 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.542 ' O ' ' HB3' ' A' ' 48' ' ' ASP . . . -115.08 -79.27 0.82 Allowed Glycine 0 N--CA 1.432 -1.602 0 N-CA-C 109.119 -1.592 . . . . 0.0 109.119 169.305 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.559 ' OD1' ' HD3' ' A' ' 63' ' ' ARG . 6.0 p-10 166.98 133.3 0.04 OUTLIER Pre-proline 0 N--CA 1.451 -0.423 0 N-CA-C 113.925 1.083 . . . . 0.0 113.925 -178.901 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.504 ' CD ' ' HB2' ' A' ' 44' ' ' ALA . 7.5 Cg_endo -96.65 152.09 1.17 Allowed 'Trans proline' 0 N--CA 1.432 -2.134 0 N-CA-C 106.828 -2.028 . . . . 0.0 106.828 132.501 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.729 HD13 HD22 ' A' ' 66' ' ' LEU . 62.1 mt -106.23 100.69 11.15 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.695 0 C-N-CA 119.566 -0.853 . . . . 0.0 110.092 -173.802 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -82.4 117.0 22.13 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.711 178.434 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.521 HG13 HG22 ' A' ' 50' ' ' ILE . 31.1 m -137.4 172.51 14.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.04 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.565 ' HB3' ' HB2' ' A' ' 39' ' ' ARG . 42.9 tt0 -123.18 123.02 39.85 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 176.121 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.7 p -85.14 -30.79 23.7 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.795 -173.091 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 46.8 ttp180 -174.17 -46.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.861 0.362 . . . . 0.0 110.862 179.546 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 21.9 mt-30 -134.37 -27.13 1.39 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.747 -175.166 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.8 t -125.8 160.64 29.3 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.852 0.358 . . . . 0.0 111.016 -176.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.3 m -86.08 142.93 28.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.276 177.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 10.3 tt -137.96 145.24 41.75 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.086 -178.587 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.539 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -121.74 143.51 49.33 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.414 179.054 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.2 pp -150.87 176.55 10.98 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 -178.705 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -96.42 156.15 16.46 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.477 0.655 . . . . 0.0 111.704 -177.609 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.559 ' HD3' ' OD1' ' A' ' 48' ' ' ASP . 28.0 ptt-85 -65.11 -33.61 76.43 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.664 179.266 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -55.43 -43.95 75.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.28 176.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -68.47 -39.46 81.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.555 177.65 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.926 HD11 HD11 ' A' ' 71' ' ' LEU . 18.6 tp -65.45 -29.04 69.67 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.987 -179.541 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.65 -15.91 63.67 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.84 178.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.43 ' HA ' ' HB3' ' A' ' 16' ' ' SER . 93.5 mt -96.92 -3.72 41.31 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.697 178.371 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.2 mt -110.3 130.0 55.63 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.133 178.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 31.4 m -92.1 116.41 28.91 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.348 0.594 . . . . 0.0 110.416 177.18 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.926 HD11 HD11 ' A' ' 66' ' ' LEU . 77.2 mt -108.57 144.77 35.82 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.102 -176.449 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.419 HG23 ' HB2' ' A' ' 11' ' ' ARG . 15.9 m -132.33 119.23 16.37 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.505 170.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 23.5 Cg_exo -63.5 163.15 24.9 Favored 'Trans proline' 0 C--O 1.237 0.473 0 C-N-CA 122.209 1.939 . . . . 0.0 112.293 -178.165 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.416 ' CD1' ' HB2' ' A' ' 9' ' ' SER . 61.0 mt -65.68 -30.4 71.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.335 173.325 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 . . . . . 0 C--O 1.251 1.132 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.779 178.443 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 mpt? . . . . . 0 N--CA 1.482 1.137 0 CA-C-O 120.551 0.215 . . . . 0.0 111.46 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.9 t -76.3 104.09 6.65 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.031 0.443 . . . . 0.0 109.9 178.389 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -131.94 146.75 52.28 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.657 -178.253 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 95.0 mt 52.4 72.68 0.39 Allowed 'General case' 0 C--N 1.329 -0.298 0 O-C-N 124.119 0.887 . . . . 0.0 113.192 179.21 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -113.41 92.23 22.52 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 168.803 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -77.17 117.56 4.45 Favored 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 122.849 2.366 . . . . 0.0 113.051 -173.116 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.5 m -73.2 -37.81 66.34 Favored 'General case' 0 N--CA 1.44 -0.964 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.446 175.312 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.6 mtt180 -155.18 157.13 36.91 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.499 -178.403 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.532 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 39.1 m -122.57 130.27 52.83 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.837 -1.074 . . . . 0.0 108.513 170.118 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -110.5 142.03 42.83 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.373 -177.545 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 12.9 ptt180 -108.05 148.67 29.45 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.303 0.573 . . . . 0.0 110.493 177.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.568 HG12 ' CD2' ' A' ' 71' ' ' LEU . 22.4 mt -90.2 113.34 26.12 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.618 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 10.5 t -91.13 -11.04 39.72 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.744 -0.382 . . . . 0.0 111.143 -178.062 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.666 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 161.36 -168.47 36.6 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.343 -0.932 . . . . 0.0 112.211 177.295 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -98.54 157.06 16.47 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 177.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.4 t -59.24 140.16 87.9 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.642 175.457 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -65.17 -14.57 45.85 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.271 1.981 . . . . 0.0 111.596 175.604 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -102.69 12.66 36.0 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.14 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.506 HG13 HD22 ' A' ' 68' ' ' LEU . 12.3 tt -76.27 146.24 9.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.126 0.489 . . . . 0.0 111.006 -177.556 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.571 ' HB2' ' HD2' ' A' ' 23' ' ' TYR . 20.4 m -84.03 145.61 28.4 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.861 175.707 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -57.25 -43.08 82.66 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.021 0.378 . . . . 0.0 112.021 -175.547 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -67.51 -35.83 87.4 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.24 -179.622 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.571 ' HD2' ' HB2' ' A' ' 20' ' ' SER . 19.2 m-85 -67.49 -35.3 78.88 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 122.847 -0.208 . . . . 0.0 110.776 177.688 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 74.2 ttt-85 -62.55 -40.25 96.24 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 174.86 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -66.59 -40.67 88.99 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.704 177.358 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 52.9 ttt180 -61.29 -45.46 94.4 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.345 176.301 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 23' ' ' TYR . 66.9 mt -65.95 -42.84 89.48 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.604 -178.139 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -60.83 -43.32 98.42 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.949 178.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 59.2 m -66.78 -29.59 69.57 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.381 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 84.2 mtp -77.91 -18.11 56.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.037 177.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 103.38 15.01 24.42 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.374 178.799 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.565 HD13 HD11 ' A' ' 69' ' ' LEU . 92.3 mt -100.93 97.94 8.47 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.008 0.432 . . . . 0.0 110.117 -179.52 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.401 HD23 ' H ' ' A' ' 33' ' ' LEU . 1.9 pt? -132.9 159.2 73.56 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.133 -177.851 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.666 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 37.1 Cg_exo -60.47 128.58 26.48 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.653 2.236 . . . . 0.0 111.455 176.361 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 115.37 -12.73 18.92 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 120.668 -0.777 . . . . 0.0 111.891 -176.741 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.5 ' HB3' HD12 ' A' ' 12' ' ' ILE . . . -89.41 176.47 6.9 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-O 121.329 0.585 . . . . 0.0 110.09 179.156 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -147.19 150.65 35.32 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.134 -177.431 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 55.3 mt -127.53 131.34 50.07 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.66 177.703 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -107.67 127.69 53.89 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.704 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 14.7 p -62.17 124.72 17.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.174 0.511 . . . . 0.0 111.592 -176.08 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 85.1 t -97.26 -52.92 8.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.696 173.077 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 38.6 mtp-105 -151.54 157.01 41.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.137 179.404 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.478 HG12 HG23 ' A' ' 50' ' ' ILE . 64.9 mt -127.65 131.87 69.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 176.252 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.459 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -65.13 141.41 98.28 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.384 178.565 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 32.0 Cg_exo -59.24 -16.0 31.9 Favored 'Trans proline' 0 N--CA 1.476 0.48 0 C-N-CA 123.259 2.639 . . . . 0.0 113.65 -174.588 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.428 HD22 ' N ' ' A' ' 46' ' ' LEU . 2.2 mm? -89.12 -16.98 30.16 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.702 0.287 . . . . 0.0 111.202 -177.563 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.72 -16.86 60.39 Favored Glycine 0 N--CA 1.454 -0.125 0 N-CA-C 111.016 -0.833 . . . . 0.0 111.016 -174.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.905 ' HB3' ' HD2' ' A' ' 49' ' ' PRO . 1.5 m-20 -65.62 170.6 4.56 Favored Pre-proline 0 C--N 1.326 -0.448 0 C-N-CA 123.601 0.761 . . . . 0.0 110.616 173.346 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.905 ' HD2' ' HB3' ' A' ' 48' ' ' ASP . 23.3 Cg_exo -19.77 151.38 0.0 OUTLIER 'Trans proline' 0 C--N 1.366 1.459 1 C-N-CA 126.675 4.917 . . . . 0.0 117.434 -163.693 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.497 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 62.3 mt -123.6 138.8 52.18 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 CA-C-N 113.862 -1.517 . . . . 0.0 110.604 -166.89 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 27.8 mp0 -86.04 119.35 26.25 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 175.301 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 28.3 m -130.83 159.11 43.11 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.824 -176.271 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -116.41 141.83 47.66 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 -178.401 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.43 ' O ' ' HB2' ' A' ' 55' ' ' ARG . 35.4 p -97.69 -45.15 6.48 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.356 0.598 . . . . 0.0 109.879 179.438 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.43 ' HB2' ' O ' ' A' ' 54' ' ' THR . 0.0 OUTLIER 167.66 -46.46 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 114.508 -1.224 . . . . 0.0 107.971 -173.238 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.53 -54.91 2.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.0 -175.706 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.9 t -126.86 144.34 51.01 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.041 -172.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 9.9 m -91.62 139.27 30.86 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.643 -178.689 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.7 mp -121.14 168.91 11.06 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.789 -178.194 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.497 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -142.18 124.9 15.93 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.321 175.019 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.576 ' HB2' ' HB2' ' A' ' 65' ' ' ASP . 3.5 pp -126.56 146.66 50.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.642 -173.119 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.715 ' HG3' ' HG3' ' A' ' 49' ' ' PRO . 1.0 OUTLIER -86.97 178.04 7.06 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.555 -175.172 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 44.5 mtt180 -54.73 -39.35 68.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.764 174.716 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.487 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 84.2 tttt -61.76 -50.68 71.39 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.86 179.053 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.576 ' HB2' ' HB2' ' A' ' 61' ' ' LEU . 24.8 m-20 -64.67 -40.05 94.73 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.928 -178.23 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 49.7 tp -59.96 -43.43 95.05 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.07 177.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.9 -13.93 62.2 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -177.487 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.506 HD22 HG13 ' A' ' 19' ' ' ILE . 97.3 mt -80.11 -28.05 39.09 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.723 0.297 . . . . 0.0 110.607 178.14 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.565 HD11 HD13 ' A' ' 32' ' ' LEU . 96.0 mt -104.71 140.86 37.45 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.414 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.9 m -92.11 113.12 25.3 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 170.805 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.568 ' CD2' HG12 ' A' ' 12' ' ' ILE . 89.6 mt -113.28 133.4 55.12 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.608 -174.689 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 17.1 m -129.71 142.02 43.86 Favored Pre-proline 0 C--N 1.316 -0.855 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.561 174.805 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -67.87 163.24 36.28 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 121.764 1.643 . . . . 0.0 111.416 179.38 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' A' ' 9' ' ' SER . 75.4 mt -59.02 -63.38 1.32 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.741 175.542 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.06 -0.972 . . . . 0.0 110.007 178.965 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.2 ttt . . . . . 0 N--CA 1.48 1.048 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.1 p -109.38 103.81 12.8 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.925 0.393 . . . . 0.0 110.632 178.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -121.96 76.83 1.32 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.247 0.546 . . . . 0.0 109.533 175.729 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.878 ' HG ' HG13 ' A' ' 41' ' ' VAL . 6.5 mp -107.92 154.34 21.74 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.924 -175.754 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -146.97 83.69 7.84 Favored Pre-proline 0 C--N 1.322 -0.628 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.037 172.674 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_exo -65.67 155.54 68.55 Favored 'Trans proline' 0 N--CA 1.463 -0.284 0 C-N-CA 122.984 2.456 . . . . 0.0 112.689 -173.7 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.8 t -133.49 -69.39 0.55 Allowed 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 176.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 54.4 mtt180 -147.12 175.22 10.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.013 0.435 . . . . 0.0 110.611 176.19 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.1 t -114.17 135.67 53.79 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 174.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -119.92 146.58 45.66 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 -174.68 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.471 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 2.5 ptp180 -104.09 147.17 27.72 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.133 0.492 . . . . 0.0 110.424 178.543 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.564 HG12 ' CD2' ' A' ' 71' ' ' LEU . 46.9 mt -86.28 113.39 24.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.797 178.055 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 3.5 m -68.4 -35.3 77.45 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.266 0.555 . . . . 0.0 110.146 178.26 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.424 ' HA2' ' HB3' ' A' ' 34' ' ' PRO . . . 159.15 -153.25 24.34 Favored Glycine 0 N--CA 1.44 -1.087 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.112 -178.394 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -100.5 151.62 21.35 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 120.908 0.385 . . . . 0.0 110.098 179.631 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.427 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 27.9 t -72.14 140.06 82.6 Favored Pre-proline 0 C--N 1.317 -0.833 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.557 176.805 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 43.5 Cg_exo -57.92 -21.03 47.32 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.664 2.243 . . . . 0.0 112.407 179.121 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.14 16.06 15.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.514 -177.644 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.522 HD11 HD12 ' A' ' 27' ' ' LEU . 15.7 tt -72.23 154.76 7.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.691 0.281 . . . . 0.0 110.412 179.34 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 21.6 t -84.05 143.78 29.51 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.875 0.369 . . . . 0.0 110.683 -178.051 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -64.3 132.33 49.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.472 178.872 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.98 -33.69 3.73 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 121.047 -0.596 . . . . 0.0 111.754 -177.471 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.406 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 61.4 t80 -65.83 -35.84 81.81 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.369 0.604 . . . . 0.0 109.539 176.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' A' ' 24' ' ' ARG . 12.3 ttm180 -58.83 -43.11 90.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.047 174.087 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -66.1 -36.5 83.33 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.699 -179.183 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.412 ' O ' ' HG3' ' A' ' 30' ' ' MET . 39.4 ttm180 -67.93 -40.4 83.35 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.298 176.59 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.57 HD13 HD21 ' A' ' 69' ' ' LEU . 64.2 mt -65.04 -43.68 91.54 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.258 179.248 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -58.1 -46.47 85.48 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.224 175.291 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.8 t -61.16 -32.86 72.59 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.344 -0.843 . . . . 0.0 110.886 179.068 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.412 ' HG3' ' O ' ' A' ' 26' ' ' ARG . 89.4 mtp -74.65 -22.16 59.04 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.863 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 109.04 16.56 11.21 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.592 -0.813 . . . . 0.0 112.342 178.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.459 HD13 HD11 ' A' ' 69' ' ' LEU . 81.9 mt -104.04 96.96 7.01 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 178.797 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.47 ' HB2' ' HD2' ' A' ' 34' ' ' PRO . 1.8 pt? -135.67 161.09 64.98 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.342 -177.124 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.47 ' HD2' ' HB2' ' A' ' 33' ' ' LEU . 19.8 Cg_endo -59.8 131.43 39.8 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.43 2.087 . . . . 0.0 111.138 174.681 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.28 9.37 39.08 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.546 -0.835 . . . . 0.0 112.244 -178.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.553 ' O ' HG13 ' A' ' 12' ' ' ILE . . . -111.9 125.63 54.24 Favored 'General case' 0 N--CA 1.445 -0.72 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 177.35 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.471 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -99.75 138.69 36.48 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 121.12 0.486 . . . . 0.0 111.263 178.167 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 64.1 mt -119.44 141.63 48.95 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.396 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.487 ' HD3' ' HB3' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -99.32 154.08 18.46 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 173.607 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 12.5 p -95.97 128.54 47.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-O 121.314 0.578 . . . . 0.0 110.871 -177.045 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.878 HG13 ' HG ' ' A' ' 4' ' ' LEU . 92.8 t -88.06 -52.22 11.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.538 175.607 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 50.5 mtp180 -158.25 136.4 10.79 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.699 179.148 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.404 HD12 ' N ' ' A' ' 43' ' ' ILE . 4.2 mp -96.73 129.51 46.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 172.87 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.448 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -69.38 131.28 90.26 Favored Pre-proline 0 C--N 1.324 -0.505 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 176.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 20.1 Cg_exo -66.36 4.58 0.94 Allowed 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 123.053 2.502 . . . . 0.0 113.089 -176.026 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -101.29 -23.67 14.36 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.48 179.14 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 97.91 -15.9 61.02 Favored Glycine 0 N--CA 1.453 -0.182 0 N-CA-C 110.536 -1.026 . . . . 0.0 110.536 -171.388 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.628 ' CB ' ' HD2' ' A' ' 49' ' ' PRO . 0.6 OUTLIER -64.85 170.29 4.25 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 114.488 -0.856 . . . . 0.0 109.888 170.901 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.669 ' HD3' ' HD3' ' A' ' 62' ' ' ARG . 3.0 Cg_exo -30.75 151.1 0.02 OUTLIER 'Trans proline' 0 C--N 1.361 1.21 0 C-N-CA 125.197 3.931 . . . . 0.0 116.395 -164.914 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 74.2 mt -121.2 133.34 68.1 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 CA-C-N 113.939 -1.482 . . . . 0.0 109.784 -172.808 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -79.41 114.37 18.29 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 177.754 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 35.4 m -121.26 177.55 3.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 179.036 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.487 ' HB3' ' HD3' ' A' ' 39' ' ' ARG . 0.9 OUTLIER -138.66 140.36 38.82 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 -178.119 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 12.6 m -115.0 -32.52 5.72 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 112.219 0.451 . . . . 0.0 112.219 -171.823 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.602 ' HG3' ' HG2' ' A' ' 56' ' ' GLN . 14.4 tpt180 -178.97 -39.71 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.694 0.283 . . . . 0.0 111.388 -170.483 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.602 ' HG2' ' HG3' ' A' ' 55' ' ' ARG . 14.5 mm100 -130.25 -47.65 1.09 Allowed 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -169.704 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.6 t -144.19 161.03 39.9 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 120.765 0.317 . . . . 0.0 110.91 -172.601 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.4 m -68.99 146.71 52.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.357 -178.318 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 58.9 tp -131.21 144.88 51.67 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.905 178.579 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -123.99 122.27 37.46 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.846 0.355 . . . . 0.0 110.256 178.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.1 pp -122.44 140.15 53.05 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.039 179.67 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.669 ' HD3' ' HD3' ' A' ' 49' ' ' PRO . 19.3 mmt180 -67.12 170.06 7.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.449 0.642 . . . . 0.0 112.193 -175.843 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.4 ptm180 -60.88 -33.6 73.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.226 176.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -64.2 -49.29 72.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.625 175.432 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.463 ' OD1' ' HB2' ' A' ' 62' ' ' ARG . 4.3 m-20 -56.46 -40.82 75.48 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-O 121.223 0.535 . . . . 0.0 109.946 177.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 61.2 tp -58.42 -43.39 88.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.783 176.164 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -73.27 -12.68 60.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.551 -177.203 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.496 HD22 ' HA ' ' A' ' 19' ' ' ILE . 97.4 mt -96.8 -16.5 20.78 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.788 179.477 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.57 HD21 HD13 ' A' ' 27' ' ' LEU . 96.1 mt -116.15 118.94 34.22 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.894 0.378 . . . . 0.0 110.286 179.678 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.0 m -77.32 114.16 15.85 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.173 0.511 . . . . 0.0 110.049 -179.282 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.564 ' CD2' HG12 ' A' ' 12' ' ' ILE . 96.1 mt -118.59 127.62 53.77 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.453 -176.711 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 28.5 m -129.73 149.15 72.19 Favored Pre-proline 0 C--N 1.319 -0.74 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 174.647 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -65.97 163.39 31.29 Favored 'Trans proline' 0 N--CA 1.46 -0.46 0 C-N-CA 121.621 1.547 . . . . 0.0 111.398 177.668 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 89.3 mt -62.5 -41.87 99.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.164 0.507 . . . . 0.0 109.799 178.67 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 29.3 t70 . . . . . 0 C--O 1.248 0.994 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.476 175.819 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.9 tpt . . . . . 0 N--CA 1.476 0.868 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.6 m -97.0 108.07 20.73 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.126 0.489 . . . . 0.0 110.702 -177.802 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -138.14 85.0 2.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.095 179.558 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -151.08 159.39 44.53 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.429 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.6 tp60 -141.69 83.17 13.27 Favored Pre-proline 0 C--N 1.32 -0.705 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -178.597 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -85.54 103.29 0.76 Allowed 'Trans proline' 0 N--CA 1.448 -1.159 0 C-N-CA 122.133 1.889 . . . . 0.0 111.299 177.104 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.406 ' H ' ' CG1' ' A' ' 40' ' ' VAL . 18.2 m -95.46 -67.91 0.83 Allowed 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.813 -177.361 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.451 ' O ' HG12 ' A' ' 40' ' ' VAL . 35.3 mmt180 -137.26 174.57 10.47 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 121.455 0.645 . . . . 0.0 110.782 -176.948 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.467 ' HB2' ' CD1' ' A' ' 74' ' ' LEU . 51.1 m -113.53 133.44 55.24 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.078 172.079 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.4 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 60.5 m-85 -111.49 127.0 55.56 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -177.456 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.511 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 12.8 ptt180 -98.01 149.25 22.66 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.105 0.479 . . . . 0.0 110.625 -179.443 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.556 HG12 ' CD2' ' A' ' 71' ' ' LEU . 21.8 mt -90.34 118.63 36.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.007 -178.366 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 2.2 p -90.89 -12.24 36.76 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.96 0.41 . . . . 0.0 111.231 178.751 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.442 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 152.69 -164.81 30.84 Favored Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.717 -0.754 . . . . 0.0 111.912 176.657 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 48.0 m-85 -97.67 150.96 20.61 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 177.276 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.478 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 20.6 m -68.21 140.62 93.2 Favored Pre-proline 0 C--N 1.317 -0.828 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 177.088 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.478 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 23.6 Cg_exo -64.41 -0.89 3.27 Favored 'Trans proline' 0 CA--C 1.531 0.337 0 C-N-CA 123.047 2.498 . . . . 0.0 113.39 -175.847 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -105.41 17.24 24.25 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.862 0.363 . . . . 0.0 110.913 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.516 HG13 HD22 ' A' ' 68' ' ' LEU . 11.4 tt -93.73 159.76 2.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.619 -179.505 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 21.8 m -95.92 149.92 21.01 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.627 177.267 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -59.04 -48.7 80.63 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.411 -178.281 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.53 -37.16 91.76 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.959 -0.639 . . . . 0.0 112.421 -179.375 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.511 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 0.1 OUTLIER -72.05 -40.0 68.67 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.546 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 56.5 ttt-85 -57.08 -44.94 83.6 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.216 0.532 . . . . 0.0 110.378 175.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -62.62 -43.42 98.84 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.429 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 -61.92 -42.47 99.13 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.309 177.596 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.73 HD22 HD12 ' A' ' 32' ' ' LEU . 78.8 mt -66.27 -44.68 82.89 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.314 -179.246 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 42.5 t80 -60.65 -44.68 96.14 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.211 -179.809 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 54.3 m -67.5 -28.93 68.26 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.499 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 69.5 mtm -82.7 -18.99 38.92 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.744 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 119.17 12.2 7.06 Favored Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 120.156 -1.021 . . . . 0.0 113.546 175.738 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.73 HD12 HD22 ' A' ' 27' ' ' LEU . 94.3 mt -102.75 97.45 7.61 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.67 -0.492 . . . . 0.0 109.67 177.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.434 ' H ' HD23 ' A' ' 33' ' ' LEU . 1.9 pt? -131.22 152.13 80.06 Favored Pre-proline 0 N--CA 1.449 -0.502 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.89 -176.214 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.442 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 23.7 Cg_exo -64.11 136.2 50.91 Favored 'Trans proline' 0 N--CA 1.463 -0.289 0 C-N-CA 122.728 2.285 . . . . 0.0 111.723 177.039 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 108.98 -14.46 34.1 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.397 -178.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.84 -179.68 7.34 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-O 121.002 0.429 . . . . 0.0 110.094 178.342 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.511 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -150.69 138.76 20.12 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.954 -176.629 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.512 ' HB3' ' HB ' ' A' ' 52' ' ' VAL . 1.3 mm? -109.56 127.1 54.24 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.707 177.106 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 18.6 ttm180 -94.21 114.83 27.01 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 176.835 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.672 ' HA ' HG12 ' A' ' 52' ' ' VAL . 5.7 p -69.77 131.5 34.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.748 0.785 . . . . 0.0 111.858 -169.839 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.0 t -104.13 -36.86 4.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.723 177.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.2 ttm180 -168.17 140.09 2.91 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -177.493 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.545 HD11 HG21 ' A' ' 40' ' ' VAL . 4.5 mp -118.72 135.1 60.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 164.618 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.674 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -73.99 142.9 80.12 Favored Pre-proline 0 C--N 1.319 -0.718 0 C-N-CA 120.859 -0.336 . . . . 0.0 111.132 -179.296 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -64.9 -12.96 36.9 Favored 'Trans proline' 0 CA--C 1.529 0.274 0 C-N-CA 123.063 2.509 . . . . 0.0 112.138 177.506 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -59.34 -27.51 65.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.066 177.06 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.28 -75.03 0.24 Allowed Glycine 0 CA--C 1.494 -1.226 0 N-CA-C 110.493 -1.043 . . . . 0.0 110.493 -176.713 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -169.49 119.18 0.58 Allowed Pre-proline 0 N--CA 1.45 -0.473 0 CA-C-O 122.333 1.064 . . . . 0.0 112.712 173.203 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.674 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 55.2 Cg_endo -111.85 179.69 0.04 OUTLIER 'Trans proline' 0 N--CA 1.434 -1.998 1 C-N-CA 125.874 4.383 . . . . 0.0 106.718 136.657 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.868 HG22 HG13 ' A' ' 52' ' ' VAL . 8.4 mt -133.94 105.75 7.64 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.8 0 C-N-CA 118.205 -1.398 . . . . 0.0 110.673 176.792 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.507 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 25.0 tp60 -86.27 113.56 22.36 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 173.589 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.868 HG13 HG22 ' A' ' 50' ' ' ILE . 16.3 m -138.44 166.18 23.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-O 120.547 0.213 . . . . 0.0 111.101 -176.097 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -120.27 122.5 41.02 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 174.63 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.9 m -86.07 -78.96 0.26 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.871 -177.438 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.1 ptt180 -148.24 7.82 0.8 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.196 -179.236 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.3 tp60 -136.38 -64.81 0.59 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.123 0.487 . . . . 0.0 110.519 -172.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.1 t -153.22 -178.61 7.07 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 -179.059 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.506 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 26.6 m -78.9 143.03 36.27 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.345 0.593 . . . . 0.0 111.142 -179.158 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.507 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 6.3 mt -131.63 170.65 14.47 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.066 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.512 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -140.62 147.21 39.01 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.821 179.366 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.472 HD21 ' HB ' ' A' ' 50' ' ' ILE . 1.3 pt? -148.92 158.33 44.09 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.865 -0.421 . . . . 0.0 109.865 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 16.1 mmt180 -100.23 173.35 6.65 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.95 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.59 -34.88 65.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.041 -179.522 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 79.2 tttt -61.71 -51.6 67.72 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.852 0.358 . . . . 0.0 110.76 177.533 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.463 ' HB3' ' HB2' ' A' ' 61' ' ' LEU . 3.3 t70 -65.3 -38.66 90.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.501 0.667 . . . . 0.0 109.504 -178.525 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.585 HD22 HD11 ' A' ' 50' ' ' ILE . 59.0 tp -60.42 -39.13 86.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.138 176.19 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.02 -17.26 64.36 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.969 -176.303 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.516 HD22 HG13 ' A' ' 19' ' ' ILE . 86.2 mt -83.45 -25.7 30.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.0 0.429 . . . . 0.0 111.005 179.354 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.702 HD11 HD13 ' A' ' 32' ' ' LEU . 88.9 mt -109.69 131.78 54.74 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.712 -176.496 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.3 m -88.37 113.59 24.12 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 175.814 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.556 ' CD2' HG12 ' A' ' 12' ' ' ILE . 75.4 mt -115.82 132.45 56.64 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.506 -175.363 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.408 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 34.7 m -127.73 141.26 40.5 Favored Pre-proline 0 C--N 1.32 -0.684 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 174.311 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 72' ' ' VAL . 22.8 Cg_exo -64.65 162.29 32.02 Favored 'Trans proline' 0 C--O 1.233 0.257 0 C-N-CA 121.74 1.627 . . . . 0.0 112.343 179.392 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.467 ' CD1' ' HB2' ' A' ' 9' ' ' SER . 75.2 mt -70.31 -45.49 66.15 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.511 173.649 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 32.9 t70 . . . . . 0 C--O 1.244 0.801 0 CA-C-O 118.228 -0.892 . . . . 0.0 109.764 179.015 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.8 ttm . . . . . 0 N--CA 1.481 1.117 0 N-CA-C 110.799 -0.075 . . . . 0.0 110.799 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.0 t 69.25 105.45 0.06 Allowed 'General case' 0 C--O 1.234 0.265 0 O-C-N 123.871 0.732 . . . . 0.0 109.719 -173.324 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -63.85 104.19 0.66 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.447 -177.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 78.3 mt -75.06 101.42 4.52 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 172.142 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.484 ' HA ' ' HD2' ' A' ' 6' ' ' PRO . 14.0 pt20 -125.47 117.59 24.91 Favored Pre-proline 0 C--N 1.322 -0.629 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 -167.225 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.504 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 18.1 Cg_endo -62.34 106.71 0.5 Allowed 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 122.0 1.8 . . . . 0.0 109.155 166.246 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 75.4 m -89.55 -90.72 0.14 Allowed 'General case' 0 N--CA 1.434 -1.236 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -165.138 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.404 ' H ' HG12 ' A' ' 40' ' ' VAL . 11.2 mpt_? -101.05 153.41 19.58 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.206 0.527 . . . . 0.0 111.506 -170.639 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.59 ' HA ' ' HA ' ' A' ' 39' ' ' ARG . 30.8 m -104.99 131.86 51.96 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.519 177.354 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.409 ' HE2' ' HB ' ' A' ' 40' ' ' VAL . 43.5 m-85 -115.21 132.33 56.64 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 -179.564 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.477 ' HG3' HG23 ' A' ' 72' ' ' VAL . 25.5 ptt180 -99.54 145.97 26.91 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.066 0.46 . . . . 0.0 110.994 -177.706 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.574 HG12 ' CD2' ' A' ' 71' ' ' LEU . 18.0 mt -93.53 119.26 41.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.281 -177.455 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 7.4 p -92.83 -19.06 22.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.8 0.333 . . . . 0.0 111.577 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.42 ' HA2' ' HB3' ' A' ' 34' ' ' PRO . . . 164.82 -151.84 21.09 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.099 179.301 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -115.58 152.84 32.3 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.882 0.372 . . . . 0.0 110.281 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.53 ' O ' HG22 ' A' ' 19' ' ' ILE . 49.2 m -78.83 150.76 75.87 Favored Pre-proline 0 N--CA 1.442 -0.846 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.497 179.433 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -70.48 11.25 0.49 Allowed 'Trans proline' 0 N--CA 1.474 0.379 0 C-N-CA 123.161 2.574 . . . . 0.0 113.598 -176.061 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -106.23 1.82 26.35 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.757 0.313 . . . . 0.0 111.04 179.02 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.53 HG22 ' O ' ' A' ' 16' ' ' SER . 16.4 tt -89.28 143.18 11.71 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 CA-C-O 120.942 0.401 . . . . 0.0 110.735 -179.053 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 21.2 t -156.41 -174.87 5.14 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 -178.054 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 61.37 -155.88 0.35 Allowed 'General case' 0 CA--C 1.537 0.472 0 O-C-N 123.467 0.48 . . . . 0.0 109.768 179.5 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -90.17 23.64 20.19 Favored Glycine 0 CA--C 1.519 0.289 0 C-N-CA 120.896 -0.668 . . . . 0.0 112.034 178.484 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.469 ' CE1' HD12 ' A' ' 68' ' ' LEU . 6.3 t80 -68.45 -38.0 80.72 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.865 0.365 . . . . 0.0 110.486 -176.612 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 15.5 ttm180 -64.62 -38.96 92.8 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.804 178.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -69.72 -32.22 70.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.733 179.115 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.3 tpp180 -65.59 -44.16 87.48 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 175.383 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.456 HD22 HD12 ' A' ' 32' ' ' LEU . 89.2 mt -66.84 -41.97 86.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.472 179.498 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -56.29 -44.76 80.17 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.274 177.586 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 50.8 m -61.6 -33.35 73.75 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.25 178.105 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 85.1 mtp -82.52 -11.76 58.24 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.37 -179.133 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 94.61 11.16 57.27 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.835 -0.697 . . . . 0.0 111.946 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.456 HD12 HD22 ' A' ' 27' ' ' LEU . 86.7 mt -92.2 90.08 7.16 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.278 0.561 . . . . 0.0 109.787 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.3 pp -145.32 161.05 43.36 Favored Pre-proline 0 C--N 1.321 -0.674 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.773 -175.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.42 ' HB3' ' HA2' ' A' ' 14' ' ' GLY . 14.7 Cg_endo -58.03 128.15 27.74 Favored 'Trans proline' 0 C--O 1.235 0.351 0 C-N-CA 122.861 2.374 . . . . 0.0 112.011 177.192 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 111.96 -14.19 26.5 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.953 -0.642 . . . . 0.0 111.631 -176.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.528 ' HB3' HD12 ' A' ' 12' ' ' ILE . . . -93.13 -179.86 5.21 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-O 121.114 0.483 . . . . 0.0 110.16 178.587 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -154.97 146.5 23.14 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.694 -177.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 57.1 mt -130.89 132.77 45.35 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.805 177.85 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.59 ' HA ' ' HA ' ' A' ' 9' ' ' SER . 79.5 ttt180 -100.06 127.44 46.29 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.304 -0.407 . . . . 0.0 109.953 178.687 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.504 ' O ' ' HA ' ' A' ' 6' ' ' PRO . 5.1 p -66.53 120.84 14.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 121.254 0.549 . . . . 0.0 109.967 -179.37 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.822 ' HB ' ' HG2' ' A' ' 51' ' ' GLN . 43.0 t -92.62 -59.43 3.01 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.922 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.547 173.165 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 56.0 mtm180 -156.23 160.38 39.76 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.202 0.525 . . . . 0.0 112.099 -179.02 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 80.4 mt -129.62 135.11 62.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 172.345 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.543 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -71.84 153.79 92.97 Favored Pre-proline 0 C--N 1.327 -0.389 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -176.284 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 25.9 Cg_exo -63.61 -17.65 60.89 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 123.678 2.919 . . . . 0.0 113.499 -179.144 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 7.1 tt -46.99 -50.4 19.21 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.958 0.885 . . . . 0.0 109.985 175.374 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.92 -46.39 0.57 Allowed Glycine 0 N--CA 1.432 -1.624 0 N-CA-C 109.799 -1.321 . . . . 0.0 109.799 -172.546 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -174.42 117.36 0.34 Allowed Pre-proline 0 N--CA 1.449 -0.479 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 174.167 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.543 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 69.4 Cg_endo -115.65 -172.87 0.02 OUTLIER 'Trans proline' 0 N--CA 1.438 -1.753 1 C-N-CA 126.969 5.112 . . . . 0.0 106.637 132.43 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.734 HG22 HG13 ' A' ' 52' ' ' VAL . 50.8 mt -140.81 117.15 7.55 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.446 0 C-N-CA 118.866 -1.134 . . . . 0.0 111.24 175.898 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.822 ' HG2' ' HB ' ' A' ' 41' ' ' VAL . 32.4 tt0 -96.55 118.32 32.79 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.051 -0.977 . . . . 0.0 108.492 174.963 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.734 HG13 HG22 ' A' ' 50' ' ' ILE . 15.4 m -135.81 165.9 28.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.393 0.616 . . . . 0.0 112.212 -176.803 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -112.91 126.14 55.14 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.06 175.527 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.4 t -82.85 -28.33 30.18 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.04 178.588 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.49 -43.42 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 114.982 -1.008 . . . . 0.0 108.644 177.471 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -130.21 -37.1 1.47 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.705 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.7 t -106.83 158.76 16.75 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.738 -177.549 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.431 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 15.3 m -101.82 157.53 16.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.67 -177.26 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.52 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 8.7 mt -135.71 163.82 29.29 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.061 0.458 . . . . 0.0 111.465 179.121 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.569 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -140.73 135.51 31.63 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.333 175.098 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -159.49 178.65 9.67 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 -175.48 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.447 ' HD3' ' HA ' ' A' ' 62' ' ' ARG . 9.8 mmt85 -109.43 169.1 8.92 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.7 0.762 . . . . 0.0 112.299 179.516 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.1 ptp180 -60.81 -37.55 82.39 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.181 -1.372 . . . . 0.0 112.328 -174.501 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -59.81 -46.56 88.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.164 0.507 . . . . 0.0 110.678 178.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -66.48 -37.08 84.31 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.159 -176.29 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.573 HD22 ' CD1' ' A' ' 50' ' ' ILE . 4.6 tp -71.4 -38.71 71.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.692 176.846 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.07 -21.94 65.86 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.727 -0.669 . . . . 0.0 112.121 -175.082 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.469 HD12 ' CE1' ' A' ' 23' ' ' TYR . 60.5 mt -79.2 -12.71 59.97 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.456 -0.497 . . . . 0.0 110.555 177.144 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.403 HD11 HD13 ' A' ' 32' ' ' LEU . 82.2 mt -97.09 138.03 35.23 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 171.85 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 17.7 m -88.4 113.87 24.44 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 173.39 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.574 ' CD2' HG12 ' A' ' 12' ' ' ILE . 77.3 mt -116.86 134.1 55.19 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.907 -175.28 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.477 HG23 ' HG3' ' A' ' 11' ' ' ARG . 29.4 m -125.51 138.92 32.77 Favored Pre-proline 0 C--N 1.317 -0.825 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 172.026 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -65.04 165.02 22.89 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 121.669 1.579 . . . . 0.0 111.286 177.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 9' ' ' SER . 89.6 mt -51.9 -31.59 29.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.525 174.815 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 38.2 t70 . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.524 -0.751 . . . . 0.0 110.654 178.655 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.412 ' HB3' ' H ' ' A' ' 2' ' ' SER . 93.8 mtp . . . . . 0 N--CA 1.485 1.308 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.412 ' H ' ' HB3' ' A' ' 1' ' ' MET . 8.1 p -69.22 89.63 0.47 Allowed 'General case' 0 C--O 1.235 0.307 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -176.365 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.534 ' HA ' ' HD3' ' A' ' 42' ' ' ARG . . . 67.0 140.42 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.555 0.742 . . . . 0.0 112.635 177.043 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.512 ' HG ' ' H ' ' A' ' 5' ' ' GLN . 10.0 tp 57.57 -147.45 0.52 Allowed 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.234 179.496 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.512 ' H ' ' HG ' ' A' ' 4' ' ' LEU . 61.0 tt0 65.88 70.99 0.51 Allowed Pre-proline 0 N--CA 1.463 0.212 0 CA-C-O 121.483 0.659 . . . . 0.0 110.012 -173.356 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.758 ' HB2' HG13 ' A' ' 40' ' ' VAL . 85.2 Cg_endo -98.3 170.08 0.65 Allowed 'Trans proline' 0 N--CA 1.447 -1.234 0 C-N-CA 123.269 2.646 . . . . 0.0 112.879 -178.76 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.527 ' O ' ' HG3' ' A' ' 8' ' ' ARG . 36.5 t -91.3 -87.95 0.19 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.77 174.485 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.527 ' HG3' ' O ' ' A' ' 7' ' ' SER . 39.1 mtp85 -155.36 153.12 29.98 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 179.758 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.501 ' HB2' ' CD1' ' A' ' 74' ' ' LEU . 52.1 m -63.24 146.1 54.12 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.252 0.549 . . . . 0.0 111.058 -177.255 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -117.27 125.2 50.72 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.996 -177.623 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.553 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 26.2 ptt180 -95.01 154.18 17.29 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.069 0.461 . . . . 0.0 110.716 -178.217 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.502 HG12 ' CD2' ' A' ' 71' ' ' LEU . 18.4 mt -94.89 119.45 42.94 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.117 -177.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 4.5 p -94.46 -17.86 22.06 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.637 0.256 . . . . 0.0 111.254 179.012 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 1.001 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 161.32 -161.12 32.8 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.44 -0.886 . . . . 0.0 112.283 177.805 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 65.8 m-85 -110.47 156.39 20.92 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.605 -0.516 . . . . 0.0 109.605 177.808 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.482 ' O ' HG22 ' A' ' 19' ' ' ILE . 49.1 m -72.77 132.17 83.45 Favored Pre-proline 0 N--CA 1.442 -0.838 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 174.376 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -63.82 2.53 0.99 Allowed 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 123.325 2.683 . . . . 0.0 113.746 -174.67 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.01 -9.31 37.26 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.018 177.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.707 HD12 ' HB3' ' A' ' 68' ' ' LEU . 11.8 tt -84.49 143.54 11.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.107 0.48 . . . . 0.0 110.784 -178.247 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 41.2 m -84.12 158.24 21.45 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.354 177.355 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -63.74 -37.5 87.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.537 -173.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.47 ' O ' ' HB2' ' A' ' 25' ' ' GLN . . . -64.08 -41.27 98.55 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.679 -178.052 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -75.51 -32.87 60.67 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 178.427 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 40.3 ttt-85 -58.58 -35.39 72.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.437 172.469 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.47 ' HB2' ' O ' ' A' ' 22' ' ' GLY . 84.1 mt-30 -65.12 -33.5 76.17 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.621 177.231 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.6 tmm_? -66.01 -41.32 91.14 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.089 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 96.2 mt -69.1 -44.67 71.99 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.447 178.386 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -59.4 -43.94 92.91 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.83 179.548 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.4 m -63.59 -32.95 74.57 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.935 178.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 77.5 mtp -77.5 -15.82 59.08 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.094 178.724 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 95.29 15.87 42.68 Favored Glycine 0 N--CA 1.446 -0.681 0 C-N-CA 120.877 -0.678 . . . . 0.0 111.93 178.612 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.432 HD13 HD11 ' A' ' 69' ' ' LEU . 90.8 mt -92.69 79.44 4.79 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.62 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.6 pp -132.97 162.08 59.79 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.98 -173.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 1.001 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 35.2 Cg_exo -58.46 122.07 11.04 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.785 2.323 . . . . 0.0 112.119 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.46 -17.05 9.69 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.344 -179.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -94.6 -176.11 3.81 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 177.575 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -157.34 138.95 13.97 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.957 -177.633 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.425 ' N ' HD22 ' A' ' 38' ' ' LEU . 2.5 mm? -99.65 135.8 40.53 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 176.142 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.455 HH11 ' HD2' ' A' ' 39' ' ' ARG . 21.8 ttt180 -96.18 111.24 23.35 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.834 -178.423 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.758 HG13 ' HB2' ' A' ' 6' ' ' PRO . 7.8 p -60.48 127.08 19.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.438 0.637 . . . . 0.0 111.495 -177.424 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 49.6 t -103.55 -55.2 5.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.472 173.136 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.534 ' HD3' ' HA ' ' A' ' 3' ' ' ALA . 48.4 mtm180 -152.33 168.09 26.54 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.87 179.47 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.418 HG13 HG23 ' A' ' 50' ' ' ILE . 4.7 mp -124.49 139.37 50.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 174.049 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.469 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -68.82 135.29 89.99 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 120.633 0.254 . . . . 0.0 110.461 178.866 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.469 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 23.9 Cg_exo -65.74 -1.57 5.18 Favored 'Trans proline' 0 N--CA 1.475 0.419 0 C-N-CA 123.117 2.545 . . . . 0.0 113.195 -178.315 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -94.38 -16.94 23.03 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.812 179.515 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.48 ' O ' ' HD2' ' A' ' 63' ' ' ARG . . . 91.88 -9.53 76.5 Favored Glycine 0 N--CA 1.454 -0.15 0 N-CA-C 110.417 -1.073 . . . . 0.0 110.417 -171.178 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.878 ' HB3' ' HD2' ' A' ' 49' ' ' PRO . 6.5 m-20 -74.2 171.55 10.88 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 114.022 -1.089 . . . . 0.0 110.285 174.895 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.878 ' HD2' ' HB3' ' A' ' 48' ' ' ASP . 14.4 Cg_exo -24.43 152.13 0.0 OUTLIER 'Trans proline' 0 C--N 1.362 1.289 1 C-N-CA 126.316 4.678 . . . . 0.0 117.291 -167.665 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.509 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 71.0 mt -109.89 138.3 38.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-N 113.638 -1.619 . . . . 0.0 109.602 -171.345 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -86.72 108.92 18.89 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 35.8 m -121.18 -179.43 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.488 ' HA ' ' HA ' ' A' ' 58' ' ' SER . 34.0 tt0 -136.87 134.36 36.79 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 179.648 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.0 p -84.07 -45.86 12.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.325 0.583 . . . . 0.0 110.317 -177.105 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 28.8 ttm180 -161.8 -59.19 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.331 -0.849 . . . . 0.0 108.98 177.038 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -111.3 -39.27 4.75 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.308 177.914 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.8 t -103.06 149.87 24.15 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.912 0.387 . . . . 0.0 111.135 -172.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.488 ' HA ' ' HA ' ' A' ' 53' ' ' GLU . 21.3 m -95.17 152.09 18.65 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.576 179.751 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 53.1 tp -143.17 146.82 34.05 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.897 -177.564 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.509 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -112.28 124.82 53.3 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.95 176.658 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.66 HD13 HD13 ' A' ' 66' ' ' LEU . 1.3 pp -109.66 125.63 52.82 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.066 0.46 . . . . 0.0 110.584 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.438 ' HG3' ' HG3' ' A' ' 49' ' ' PRO . 2.9 mpt_? -67.24 171.98 5.24 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.068 -177.743 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.48 ' HD2' ' O ' ' A' ' 47' ' ' GLY . 0.0 OUTLIER -67.27 -44.52 79.13 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.589 179.445 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 60.0 tttp -70.71 -40.37 72.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.972 0.415 . . . . 0.0 110.324 177.624 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -63.75 -35.23 79.88 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.967 178.386 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.66 HD13 HD13 ' A' ' 61' ' ' LEU . 40.7 tp -68.81 -38.13 79.71 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.561 174.468 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.01 -15.43 63.02 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.903 -176.494 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.707 ' HB3' HD12 ' A' ' 19' ' ' ILE . 72.0 mt -83.87 -24.75 30.73 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.011 0.434 . . . . 0.0 110.751 177.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.432 HD11 HD13 ' A' ' 32' ' ' LEU . 87.8 mt -102.81 141.77 35.06 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.446 179.652 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.1 m -96.42 113.42 25.0 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 170.547 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.502 ' CD2' HG12 ' A' ' 12' ' ' ILE . 51.7 mt -121.19 137.1 54.83 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.628 -176.263 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 34.6 m -132.36 150.24 75.37 Favored Pre-proline 0 C--N 1.321 -0.653 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 174.053 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -60.21 163.75 13.95 Favored 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 121.863 1.708 . . . . 0.0 111.716 177.311 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.501 ' CD1' ' HB2' ' A' ' 9' ' ' SER . 74.8 mt -66.22 -12.17 54.48 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.022 175.861 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.3 t70 . . . . . 0 C--O 1.249 1.033 0 O-C-N 124.285 0.991 . . . . 0.0 110.311 -178.095 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 35.3 t . . . . . 0 N--CA 1.454 -0.27 0 CA-C-O 121.203 0.525 . . . . 0.0 109.87 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.464 ' O ' HG12 ' A' ' 40' ' ' VAL . 54.0 mtt180 -145.72 159.65 42.86 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.425 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.418 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 69.4 m -120.82 133.92 55.3 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.717 173.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.554 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 56.6 m-85 -114.35 129.21 56.64 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.666 -177.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.561 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 85.0 mtt180 -92.38 157.9 16.36 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.0 0.429 . . . . 0.0 110.692 178.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 51.8 mt -95.74 104.79 16.23 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 173.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.579 ' HB ' HG22 ' A' ' 72' ' ' VAL . 2.9 t -81.94 -14.61 55.86 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.128 0.49 . . . . 0.0 110.444 -175.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.731 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 157.93 -163.68 32.86 Favored Glycine 0 N--CA 1.442 -0.956 0 C-N-CA 120.886 -0.674 . . . . 0.0 112.038 179.308 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -97.71 153.38 18.28 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 88.7 p -74.38 162.17 74.95 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.869 -179.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_exo -71.39 -12.64 29.88 Favored 'Trans proline' 0 CA--C 1.529 0.229 0 C-N-CA 122.58 2.186 . . . . 0.0 112.095 174.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -89.12 -0.99 57.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.742 -178.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.455 HD11 ' CA ' ' A' ' 24' ' ' ARG . 18.6 tt -65.6 124.92 21.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.984 0.421 . . . . 0.0 110.017 179.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.5 m -138.77 159.35 42.34 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.848 -0.341 . . . . 0.0 111.876 -172.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 64.1 t30 60.46 41.19 16.22 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 115.549 -0.75 . . . . 0.0 112.687 168.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 70.19 21.97 77.28 Favored Glycine 0 C--N 1.331 0.261 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.988 174.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.516 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -65.88 -23.18 66.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.729 0.265 . . . . 0.0 111.294 179.823 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.455 ' CA ' HD11 ' A' ' 19' ' ' ILE . 6.0 ttm-85 -59.61 -36.3 76.05 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 121.342 0.592 . . . . 0.0 109.507 176.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -69.24 -36.42 77.16 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.781 179.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 25.2 tpp180 -67.01 -42.22 85.33 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 176.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 23' ' ' TYR . 84.1 mt -66.15 -43.13 87.87 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.232 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -61.55 -41.36 97.24 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.175 0.512 . . . . 0.0 110.242 178.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 63.3 m -60.47 -35.69 76.5 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.801 175.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 71.4 mtm -84.29 -11.52 56.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.613 -178.002 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 93.55 27.72 12.56 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.911 -0.662 . . . . 0.0 112.662 177.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.61 HD13 HD11 ' A' ' 69' ' ' LEU . 94.5 mt -105.74 102.77 12.2 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.083 0.468 . . . . 0.0 110.573 178.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.413 HD23 ' N ' ' A' ' 33' ' ' LEU . 1.8 pt? -138.02 157.11 73.63 Favored Pre-proline 0 N--CA 1.448 -0.574 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.225 -179.35 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.731 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 28.6 Cg_exo -62.13 136.8 62.6 Favored 'Trans proline' 0 C--O 1.233 0.275 0 C-N-CA 122.573 2.182 . . . . 0.0 111.92 178.05 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 114.69 -17.74 17.85 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.323 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -86.03 175.99 8.27 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-O 121.046 0.451 . . . . 0.0 110.215 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.561 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -148.56 148.18 29.88 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.045 -177.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 49.0 mt -122.7 130.24 52.72 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.084 178.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 14.5 ttm180 -98.13 119.6 37.07 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.41 178.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.491 ' HA ' HG12 ' A' ' 52' ' ' VAL . 13.4 p -61.3 127.3 20.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -171.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.439 ' O ' ' HB3' ' A' ' 42' ' ' ARG . 76.1 t -98.0 -54.66 6.75 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 165.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.439 ' HB3' ' O ' ' A' ' 41' ' ' VAL . 15.9 ptt180 173.3 156.14 0.11 Allowed 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.359 0.6 . . . . 0.0 111.944 174.67 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.401 HG23 ' O ' ' A' ' 49' ' ' PRO . 84.4 mt -118.15 142.27 33.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 170.08 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.67 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -74.81 134.04 75.67 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-O 120.501 0.191 . . . . 0.0 110.556 176.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -66.8 -19.86 52.66 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 123.233 2.622 . . . . 0.0 112.999 -174.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 46' ' ' LEU . 4.0 mm? -51.48 -44.85 62.58 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.567 0.699 . . . . 0.0 110.509 176.541 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -174.97 -74.16 0.05 OUTLIER Glycine 0 N--CA 1.431 -1.651 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.328 -177.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.508 ' OD1' ' HD3' ' A' ' 63' ' ' ARG . 6.8 p-10 -177.97 127.16 0.28 Allowed Pre-proline 0 N--CA 1.442 -0.858 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 -179.088 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.67 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 73.5 Cg_endo -114.28 -168.2 0.02 OUTLIER 'Trans proline' 0 N--CA 1.43 -2.236 0 C-N-CA 124.482 3.455 . . . . 0.0 106.569 129.295 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.743 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 58.6 mt -145.1 99.9 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.35 0 C-N-CA 119.93 -0.708 . . . . 0.0 109.432 170.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.417 ' HA ' ' OE1' ' A' ' 51' ' ' GLN . 14.2 mm-40 -86.41 121.45 28.98 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 174.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.491 HG12 ' HA ' ' A' ' 40' ' ' VAL . 9.5 m -142.22 172.76 8.48 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.927 -179.047 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -122.22 150.82 41.75 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 177.078 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 29.3 p -120.11 -30.46 4.66 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -173.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 27.2 tpt180 178.61 -54.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.864 -175.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -143.82 4.79 1.32 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.568 -179.19 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.9 t -149.93 138.73 20.91 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.234 0.54 . . . . 0.0 111.063 -175.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.1 p -80.22 148.78 30.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.402 -178.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.582 HD13 ' N ' ' A' ' 60' ' ' ALA . 2.4 tm? -129.56 148.73 51.49 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.22 -0.445 . . . . 0.0 109.906 -178.366 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.743 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -139.72 148.11 41.85 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.969 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.585 HD11 HD12 ' A' ' 50' ' ' ILE . 3.9 pp -162.98 -179.18 6.56 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.543 -0.539 . . . . 0.0 109.543 -179.066 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 26.0 mmm-85 -110.83 170.06 8.35 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 122.03 0.919 . . . . 0.0 112.286 -177.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.508 ' HD3' ' OD1' ' A' ' 48' ' ' ASP . 18.1 ptt-85 -62.98 -35.17 79.28 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 113.771 -1.559 . . . . 0.0 111.455 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -71.52 -33.95 69.64 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.015 -178.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -75.31 -36.73 61.07 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.389 0.614 . . . . 0.0 109.536 176.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.622 HD11 HD11 ' A' ' 71' ' ' LEU . 37.6 tp -64.38 -30.39 71.43 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.737 175.028 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.09 -9.77 48.76 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.591 -178.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.482 ' HB3' HD11 ' A' ' 27' ' ' LEU . 63.6 mt -91.79 -5.38 53.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.041 0.448 . . . . 0.0 110.568 175.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.61 HD11 HD13 ' A' ' 32' ' ' LEU . 95.8 mt -119.83 153.75 35.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.952 -178.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 15.8 m -113.3 121.22 43.76 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.02 -0.537 . . . . 0.0 109.577 170.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.622 HD11 HD11 ' A' ' 66' ' ' LEU . 64.8 mt -103.46 146.37 28.62 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.263 0.554 . . . . 0.0 111.578 -175.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.579 HG22 ' HB ' ' A' ' 13' ' ' THR . 12.3 m -129.49 117.86 18.82 Favored Pre-proline 0 C--N 1.322 -0.63 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.669 173.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.554 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 7.9 Cg_exo -70.95 163.02 40.67 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 121.995 1.796 . . . . 0.0 111.728 -178.416 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 9' ' ' SER . 86.7 mt -58.33 -47.95 82.1 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 172.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 . . . . . 0 C--O 1.25 1.116 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.72 174.685 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.516 ' HB3' ' HD3' ' A' ' 8' ' ' ARG . 22.9 t . . . . . 0 N--CA 1.452 -0.347 0 CA-C-O 121.006 0.431 . . . . 0.0 110.183 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.516 ' HD3' ' HB3' ' A' ' 7' ' ' SER . 0.0 OUTLIER -143.82 157.09 44.61 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.282 -179.864 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.424 ' HB2' ' CD1' ' A' ' 74' ' ' LEU . 15.3 m -105.1 164.13 12.04 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 176.021 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -127.87 132.84 49.33 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.865 -0.334 . . . . 0.0 110.989 -176.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.479 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 17.1 mtp180 -91.1 152.23 20.7 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.18 -0.464 . . . . 0.0 109.771 175.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.547 HG12 ' CD2' ' A' ' 71' ' ' LEU . 33.5 mt -102.9 117.62 48.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 176.495 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 2.9 p -87.34 -24.47 24.26 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.11 0.481 . . . . 0.0 110.74 177.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 165.62 -154.19 24.71 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.822 -0.704 . . . . 0.0 111.752 -179.185 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.473 ' CE1' ' HG3' ' A' ' 24' ' ' ARG . 44.9 m-85 -113.82 152.97 29.9 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 -177.016 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.435 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 20.9 m -70.35 140.21 87.47 Favored Pre-proline 0 C--N 1.319 -0.741 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.395 177.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 34.8 Cg_exo -61.57 -20.51 69.02 Favored 'Trans proline' 0 CA--C 1.529 0.265 0 C-N-CA 122.874 2.382 . . . . 0.0 112.22 179.524 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.68 29.24 2.37 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.933 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.521 HG13 HD22 ' A' ' 68' ' ' LEU . 19.8 tt -74.58 149.72 7.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.534 179.003 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.489 ' O ' ' HB2' ' A' ' 23' ' ' TYR . 9.3 m -89.43 117.94 28.72 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -173.153 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 24.47 88.15 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 115.407 1.632 . . . . 0.0 115.407 165.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.66 9.13 55.05 Favored Glycine 0 CA--C 1.517 0.176 0 N-CA-C 114.797 0.679 . . . . 0.0 114.797 171.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.489 ' HB2' ' O ' ' A' ' 20' ' ' SER . 0.9 OUTLIER -64.97 -23.06 67.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 117.75 0.775 . . . . 0.0 111.37 179.785 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.473 ' HG3' ' CE1' ' A' ' 15' ' ' TYR . 34.2 ttm180 -56.02 -46.58 78.75 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 121.165 0.507 . . . . 0.0 110.0 174.083 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -65.04 -34.48 78.54 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.996 -178.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 33.9 ttm180 -73.16 -39.85 65.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.157 178.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.515 HD22 HD12 ' A' ' 32' ' ' LEU . 95.3 mt -68.68 -43.57 75.84 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.26 -178.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -60.89 -42.44 97.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.248 179.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 69.9 m -67.4 -31.05 71.01 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.22 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.425 ' CE ' HD23 ' A' ' 27' ' ' LEU . 68.0 mtm -79.16 -27.67 42.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.233 179.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 124.48 4.51 7.52 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.32 -0.943 . . . . 0.0 112.857 177.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.543 HD13 HD11 ' A' ' 69' ' ' LEU . 92.1 mt -97.15 93.73 6.73 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 pp -139.05 159.05 68.38 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.615 -173.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.25 121.56 10.12 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.787 2.325 . . . . 0.0 112.08 177.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 114.74 -19.92 15.58 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 121.055 -0.593 . . . . 0.0 111.797 -176.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.492 ' O ' HG13 ' A' ' 12' ' ' ILE . . . -83.81 106.9 15.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.227 0.537 . . . . 0.0 110.46 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.479 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -88.58 116.33 26.75 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.772 177.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.49 HD13 HG21 ' A' ' 52' ' ' VAL . 70.5 mt -94.59 134.15 37.45 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.311 0.577 . . . . 0.0 110.236 -177.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 49.5 ttt180 -98.25 115.1 27.67 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.728 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.555 ' HA ' HG12 ' A' ' 52' ' ' VAL . 99.4 t -64.03 120.43 10.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 123.402 0.439 . . . . 0.0 111.275 -178.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.682 HG12 ' HG3' ' A' ' 42' ' ' ARG . 53.1 t -98.14 -53.56 7.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.52 174.171 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.682 ' HG3' HG12 ' A' ' 41' ' ' VAL . 25.7 mtp180 -148.46 140.12 23.66 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -173.279 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.2 mp -120.14 141.11 41.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 168.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.811 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -79.39 134.5 58.45 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-O 120.566 0.222 . . . . 0.0 110.868 176.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -64.64 -7.56 14.95 Favored 'Trans proline' 0 N--CA 1.479 0.636 0 C-N-CA 123.384 2.723 . . . . 0.0 113.159 -177.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.15 -37.93 81.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.593 0.711 . . . . 0.0 110.891 175.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.449 ' O ' ' HB2' ' A' ' 48' ' ' ASP . . . 174.3 -76.42 0.08 OUTLIER Glycine 0 N--CA 1.436 -1.332 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 -175.517 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.449 ' HB2' ' O ' ' A' ' 47' ' ' GLY . 17.2 t70 -179.58 118.37 0.22 Allowed Pre-proline 0 N--CA 1.453 -0.306 0 N-CA-C 113.658 0.985 . . . . 0.0 113.658 173.131 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.811 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 30.7 Cg_endo -111.49 160.77 0.05 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.441 1 C-N-CA 126.049 4.499 . . . . 0.0 108.835 139.309 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.667 HG22 HG13 ' A' ' 52' ' ' VAL . 2.7 mp -119.64 106.09 18.51 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.69 0 C-N-CA 118.89 -1.124 . . . . 0.0 110.028 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.535 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 0.8 OUTLIER -86.5 111.8 20.92 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 174.436 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.667 HG13 HG22 ' A' ' 50' ' ' ILE . 21.4 m -124.01 173.15 10.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.305 0.574 . . . . 0.0 111.922 -174.181 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -120.02 128.27 53.38 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.912 179.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.5 m -86.16 -40.01 16.08 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 173.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 26.2 ttp85 -179.63 -49.88 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.781 -1.099 . . . . 0.0 108.537 173.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -128.63 -24.22 3.04 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.095 174.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.8 t -93.12 138.95 31.08 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 121.131 0.491 . . . . 0.0 109.679 177.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 21.7 m -109.35 137.18 47.6 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.672 178.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.535 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 12.1 mt -123.84 152.13 42.64 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.98 -177.193 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.411 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -129.98 118.61 21.89 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 114.946 -1.025 . . . . 0.0 109.16 177.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.494 ' HB2' ' HB2' ' A' ' 65' ' ' ASP . 0.7 OUTLIER -124.26 150.05 45.78 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -174.74 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.574 ' HD3' ' N ' ' A' ' 62' ' ' ARG . 0.8 OUTLIER -97.89 176.43 5.79 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 120.953 0.406 . . . . 0.0 110.436 -176.154 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -54.01 -34.42 59.85 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.086 175.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.1 -45.72 90.14 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.981 177.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.494 ' HB2' ' HB2' ' A' ' 61' ' ' LEU . 5.1 m-20 -67.34 -41.68 84.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.064 178.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 62.1 tp -59.07 -37.82 77.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.822 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.97 -25.01 66.91 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.55 -178.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.521 HD22 HG13 ' A' ' 19' ' ' ILE . 81.8 mt -88.97 -15.83 33.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.236 -176.367 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.543 HD11 HD13 ' A' ' 32' ' ' LEU . 96.3 mt -110.33 143.2 40.91 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.965 0.412 . . . . 0.0 111.258 -175.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 20.4 m -101.57 114.1 27.84 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 172.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.547 ' CD2' HG12 ' A' ' 12' ' ' ILE . 75.0 mt -111.4 143.8 41.63 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.212 -174.517 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.497 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 16.3 m -126.37 123.77 24.24 Favored Pre-proline 0 C--N 1.317 -0.818 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.215 173.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.497 ' HD3' ' HA ' ' A' ' 72' ' ' VAL . 13.5 Cg_exo -70.01 161.48 45.82 Favored 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 122.201 1.934 . . . . 0.0 112.427 -175.407 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.424 ' CD1' ' HB2' ' A' ' 9' ' ' SER . 66.9 mt -74.89 -38.88 61.76 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.007 171.539 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.2 t70 . . . . . 0 C--O 1.25 1.096 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.211 -178.821 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 31.8 t . . . . . 0 N--CA 1.452 -0.357 0 CA-C-O 120.675 0.274 . . . . 0.0 110.496 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.451 ' H ' HG12 ' A' ' 40' ' ' VAL . 47.1 mtp180 -128.64 167.68 16.84 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 120.816 0.341 . . . . 0.0 110.91 -178.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.52 ' HB2' HD12 ' A' ' 74' ' ' LEU . 21.7 m -121.93 142.89 49.82 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.058 0.456 . . . . 0.0 111.621 -173.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.46 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 73.2 m-85 -123.11 135.71 54.49 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.001 179.222 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.512 ' HG3' HG23 ' A' ' 72' ' ' VAL . 34.5 ptt180 -107.06 154.24 21.42 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.071 0.462 . . . . 0.0 110.48 179.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.444 HG12 ' CD2' ' A' ' 71' ' ' LEU . 26.6 mt -99.21 114.54 37.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.624 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 12.3 t -89.51 -18.44 26.66 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.755 0.312 . . . . 0.0 110.91 -177.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.575 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 167.39 -168.24 40.39 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.855 -0.688 . . . . 0.0 111.569 179.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -102.02 155.8 17.95 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.969 0.384 . . . . 0.0 110.315 177.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.502 ' O ' HG22 ' A' ' 19' ' ' ILE . 23.5 m -76.68 145.01 74.25 Favored Pre-proline 0 N--CA 1.442 -0.854 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.598 175.169 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 26.6 Cg_exo -62.91 0.39 1.61 Allowed 'Trans proline' 0 N--CA 1.477 0.512 0 C-N-CA 123.21 2.607 . . . . 0.0 114.088 -173.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.94 3.63 54.74 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.764 0.316 . . . . 0.0 111.151 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.502 HG22 ' O ' ' A' ' 16' ' ' SER . 15.4 tt -84.63 124.59 39.98 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-O 121.371 0.605 . . . . 0.0 110.793 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.2 m -156.12 -176.08 5.77 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.985 -177.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 66.2 t30 64.01 29.27 14.34 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 122.949 0.5 . . . . 0.0 112.06 170.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 81.8 5.56 89.72 Favored Glycine 0 N--CA 1.454 -0.166 0 C-N-CA 121.13 -0.557 . . . . 0.0 113.141 176.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -61.4 -26.46 67.87 Favored 'General case' 0 C--N 1.33 -0.262 0 O-C-N 122.704 -0.292 . . . . 0.0 111.631 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.462 ' HA ' HD11 ' A' ' 19' ' ' ILE . 12.3 ttm180 -64.97 -40.53 95.12 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.826 0.346 . . . . 0.0 110.198 178.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -61.66 -43.92 97.94 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.279 178.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -60.65 -42.88 97.86 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.296 178.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 75.7 mt -70.26 -41.59 73.27 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.497 -178.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -60.35 -46.41 90.03 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.261 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 74.5 m -65.59 -28.35 69.07 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.588 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 69.4 mtm -85.04 -9.26 58.18 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.959 178.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 96.34 24.44 14.31 Favored Glycine 0 C--N 1.33 0.218 0 C-N-CA 120.932 -0.651 . . . . 0.0 112.992 174.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.601 HD13 HD11 ' A' ' 69' ' ' LEU . 84.8 mt -112.28 94.09 4.76 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.897 0.379 . . . . 0.0 110.196 179.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.401 HD23 ' N ' ' A' ' 33' ' ' LEU . 1.8 pt? -137.96 159.61 67.85 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.381 -178.004 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.575 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 17.9 Cg_exo -66.23 138.73 52.49 Favored 'Trans proline' 0 N--CA 1.464 -0.256 0 C-N-CA 122.512 2.142 . . . . 0.0 111.495 177.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 100.65 -1.02 55.48 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.675 -0.774 . . . . 0.0 111.863 -177.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -103.43 -174.76 2.62 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 176.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.438 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -159.79 151.25 19.87 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.717 -176.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.578 HD13 HG21 ' A' ' 52' ' ' VAL . 85.4 mt -131.86 138.48 48.47 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.618 178.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 -110.37 127.43 55.06 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.924 -178.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.451 HG12 ' H ' ' A' ' 8' ' ' ARG . 8.5 p -65.5 126.04 23.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.351 0.596 . . . . 0.0 111.216 -175.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.651 HG12 ' HG3' ' A' ' 42' ' ' ARG . 65.2 t -96.83 -57.72 4.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.43 -0.804 . . . . 0.0 109.587 172.363 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.651 ' HG3' HG12 ' A' ' 41' ' ' VAL . 57.3 mtp180 -146.93 158.84 44.03 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.597 -179.189 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 61.2 mt -117.71 141.26 37.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.484 ' HB3' ' O ' ' A' ' 48' ' ' ASP . . . -72.21 150.8 92.21 Favored Pre-proline 0 C--O 1.233 0.222 0 CA-C-O 120.606 0.241 . . . . 0.0 110.859 178.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -54.89 -18.39 16.37 Favored 'Trans proline' 0 CA--C 1.535 0.534 0 C-N-CA 123.657 2.904 . . . . 0.0 114.854 -174.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 77.5 mt -103.41 -31.53 9.96 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 -175.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 118.18 -27.99 7.12 Favored Glycine 0 N--CA 1.453 -0.178 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 -171.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.784 ' HB3' ' HD2' ' A' ' 49' ' ' PRO . 0.2 OUTLIER -61.16 170.32 1.67 Allowed Pre-proline 0 C--O 1.221 -0.439 0 CA-C-O 118.346 -0.835 . . . . 0.0 109.113 168.47 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.784 ' HD2' ' HB3' ' A' ' 48' ' ' ASP . 17.1 Cg_exo -18.67 150.77 0.0 OUTLIER 'Trans proline' 0 C--N 1.362 1.273 1 C-N-CA 126.582 4.855 . . . . 0.0 117.988 -153.623 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 67.0 mt -123.91 140.37 47.56 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.971 0 CA-C-N 113.579 -1.646 . . . . 0.0 110.103 -170.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -84.37 112.63 20.51 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 178.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.578 HG21 HD13 ' A' ' 38' ' ' LEU . 26.7 m -119.41 168.92 11.15 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 120.738 0.304 . . . . 0.0 110.729 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -125.83 142.61 51.43 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.025 -176.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 11.8 m -96.87 -59.5 1.79 Allowed 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 172.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -141.65 -35.22 0.46 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.175 -0.92 . . . . 0.0 109.39 176.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -151.21 -35.06 0.14 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.775 173.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 2.0 m -67.25 135.04 52.78 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.914 -178.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.463 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 5.6 m -96.96 133.31 41.78 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.045 176.305 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.5 mp -115.98 148.08 40.5 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.281 -179.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -145.56 114.15 6.78 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.904 177.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.552 HD11 HD13 ' A' ' 66' ' ' LEU . 2.9 pp -135.96 153.6 51.36 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.592 -178.17 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.586 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 24.2 mmt180 -64.49 166.53 8.27 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.496 0.665 . . . . 0.0 112.02 -176.057 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 56.8 mtm180 -75.06 -32.94 61.65 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.045 178.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -58.33 -39.8 80.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.827 173.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -75.49 -40.13 57.66 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.601 178.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.695 HD11 HD11 ' A' ' 71' ' ' LEU . 26.9 tp -64.12 -26.62 68.62 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.779 179.614 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.89 -19.67 65.03 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.413 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 96.1 mt -73.47 -25.06 60.31 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.959 0.409 . . . . 0.0 110.545 178.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.601 HD11 HD13 ' A' ' 32' ' ' LEU . 75.7 mt -98.11 130.99 44.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.168 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 27.0 m -89.25 114.29 25.62 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 174.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.695 HD11 HD11 ' A' ' 66' ' ' LEU . 83.0 mt -110.74 144.2 40.07 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.284 -171.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.512 HG23 ' HG3' ' A' ' 11' ' ' ARG . 5.1 m -136.62 135.38 20.38 Favored Pre-proline 0 C--N 1.318 -0.762 0 CA-C-N 115.045 -0.979 . . . . 0.0 109.028 171.35 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.46 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 5.4 Cg_exo -72.93 162.83 40.01 Favored 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 121.897 1.732 . . . . 0.0 112.167 -177.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.52 HD12 ' HB2' ' A' ' 9' ' ' SER . 74.8 mt -82.81 -36.02 25.91 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 171.002 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 34.0 t70 . . . . . 0 C--O 1.253 1.26 0 CA-C-N 114.336 -1.302 . . . . 0.0 109.234 170.714 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.457 ' HB3' HG11 ' A' ' 40' ' ' VAL . 22.8 t . . . . . 0 N--CA 1.45 -0.453 0 N-CA-C 109.789 -0.448 . . . . 0.0 109.789 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.446 ' O ' HG12 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -135.56 -179.93 5.95 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.936 0.398 . . . . 0.0 111.085 177.466 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.524 ' HB2' HD12 ' A' ' 74' ' ' LEU . 6.6 m -114.91 139.18 50.0 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.742 -177.112 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 36.3 m-85 -119.97 132.07 55.38 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.672 -178.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.432 ' HG3' HG23 ' A' ' 72' ' ' VAL . 1.9 ptp180 -96.68 148.72 22.59 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.025 0.441 . . . . 0.0 110.052 176.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.519 HD12 ' HB3' ' A' ' 36' ' ' ALA . 22.1 mt -92.91 114.3 29.45 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.14 -178.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 17.8 p -85.05 -22.58 28.93 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.946 0.403 . . . . 0.0 110.443 176.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 161.95 -150.35 19.65 Favored Glycine 0 N--CA 1.441 -0.972 0 C-N-CA 120.41 -0.9 . . . . 0.0 112.094 177.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -106.59 164.69 11.86 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 -179.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.416 ' HB2' ' O ' ' A' ' 67' ' ' ALA . 33.1 t -52.44 131.73 44.19 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 123.435 0.46 . . . . 0.0 110.767 175.388 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 20.7 Cg_exo -66.35 -5.01 11.67 Favored 'Trans proline' 0 C--N 1.343 0.245 0 C-N-CA 122.843 2.362 . . . . 0.0 112.243 178.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -122.09 26.42 8.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.71 178.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 18.4 tt -72.03 151.96 8.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 177.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 26.5 t -130.39 160.04 35.19 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 120.976 0.417 . . . . 0.0 111.77 -171.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.6 m120 63.77 -105.55 0.15 Allowed 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.923 172.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -148.68 27.61 1.32 Allowed Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.017 -177.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -65.74 -27.75 68.54 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 7.1 ttm180 -56.75 -42.64 79.68 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.383 175.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -68.68 -34.56 75.87 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.579 -178.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.1 tpp180 -61.94 -47.86 83.01 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.296 0.57 . . . . 0.0 109.749 173.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.408 HD13 HD21 ' A' ' 69' ' ' LEU . 97.8 mt -66.38 -41.77 88.91 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.53 -177.503 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -59.39 -45.22 92.06 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.558 -0.747 . . . . 0.0 110.32 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 45.9 m -65.01 -34.36 78.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.746 179.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.532 ' HA ' ' CE ' ' A' ' 30' ' ' MET . 10.3 mmt -73.1 -19.99 61.03 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.079 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 105.81 9.91 31.69 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.556 -0.831 . . . . 0.0 112.132 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.655 HD13 HD11 ' A' ' 69' ' ' LEU . 93.0 mt -98.52 97.94 9.19 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 178.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.8 pp -143.85 160.82 48.76 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.624 -176.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -60.96 133.25 46.36 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.513 2.142 . . . . 0.0 111.677 178.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 113.88 -17.15 20.4 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.328 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.519 ' HB3' HD12 ' A' ' 12' ' ' ILE . . . -93.27 -178.22 4.69 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-O 121.274 0.559 . . . . 0.0 110.323 179.14 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -149.1 151.88 35.19 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.287 -177.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 71.3 mt -129.24 138.17 51.51 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.211 0.529 . . . . 0.0 110.612 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 34.6 ttm180 -98.01 116.07 29.48 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.129 175.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.554 ' HA ' HG12 ' A' ' 52' ' ' VAL . 7.9 p -67.01 128.16 29.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.222 0.534 . . . . 0.0 110.337 -178.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.9 HG12 ' HG3' ' A' ' 42' ' ' ARG . 46.8 t -98.91 -53.9 7.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.243 178.066 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.9 ' HG3' HG12 ' A' ' 41' ' ' VAL . 46.3 mtt180 -157.43 138.21 13.2 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -173.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.6 mp -112.35 106.61 21.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 157.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.559 ' HB3' ' HD3' ' A' ' 49' ' ' PRO . . . -53.16 128.89 49.53 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 120.582 0.23 . . . . 0.0 111.387 -173.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -61.25 -6.41 6.6 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 123.465 2.777 . . . . 0.0 112.666 -179.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.443 HD13 ' HA ' ' A' ' 46' ' ' LEU . 3.7 mm? -58.82 -34.53 71.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.343 172.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 164.9 -76.29 0.15 Allowed Glycine 0 CA--C 1.494 -1.235 0 N-CA-C 109.862 -1.295 . . . . 0.0 109.862 -175.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -176.19 119.92 0.3 Allowed Pre-proline 0 N--CA 1.449 -0.477 0 N-CA-C 114.266 1.21 . . . . 0.0 114.266 171.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.559 ' HD3' ' HB3' ' A' ' 44' ' ' ALA . 55.2 Cg_endo -115.47 166.32 0.03 OUTLIER 'Trans proline' 0 N--CA 1.438 -1.774 1 C-N-CA 125.736 4.291 . . . . 0.0 109.159 134.869 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.604 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 59.5 mt -116.84 100.32 10.09 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.703 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.979 179.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.492 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 35.8 mt-30 -92.74 115.38 28.06 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.423 179.605 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.554 HG12 ' HA ' ' A' ' 40' ' ' VAL . 19.8 m -131.53 171.92 17.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.486 -177.208 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -134.63 133.62 40.33 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 17.9 m -82.95 -73.02 0.42 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.779 0.323 . . . . 0.0 111.071 -177.08 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.474 ' HD2' ' O ' ' A' ' 55' ' ' ARG . 7.4 tmm_? -167.82 23.36 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.435 ' HB2' ' O ' ' A' ' 55' ' ' ARG . 8.4 tt0 171.59 -29.76 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.553 -175.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.5 t -130.24 143.93 51.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.146 -175.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 34.7 t -103.31 146.24 28.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.386 0.612 . . . . 0.0 110.762 -178.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.492 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 2.7 mm? -128.32 166.96 17.63 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.161 -178.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.604 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -149.39 133.94 17.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.85 179.129 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -151.59 174.34 13.56 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -175.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.491 ' N ' ' HD2' ' A' ' 62' ' ' ARG . 8.4 mpt_? -104.88 167.1 9.93 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 120.891 0.376 . . . . 0.0 111.363 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -43.98 -56.71 3.77 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 115.08 -0.964 . . . . 0.0 112.902 177.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -56.0 -40.12 72.89 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.272 0.558 . . . . 0.0 111.149 -176.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -70.76 -31.23 67.96 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.166 -176.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.472 HD11 HD12 ' A' ' 71' ' ' LEU . 18.2 tp -68.26 -39.49 82.18 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.295 176.408 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.416 ' O ' ' HB2' ' A' ' 16' ' ' SER . . . -63.91 -14.11 50.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.859 -177.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 83.8 mt -80.33 -16.49 54.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.985 0.421 . . . . 0.0 110.68 177.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.655 HD11 HD13 ' A' ' 32' ' ' LEU . 80.2 mt -109.2 151.35 26.6 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.018 176.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 26.3 m -107.5 114.26 28.15 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.351 0.596 . . . . 0.0 109.996 172.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.511 ' CD2' HG12 ' A' ' 12' ' ' ILE . 58.7 mt -122.45 137.48 54.86 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.162 -0.927 . . . . 0.0 110.335 -175.277 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.435 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 27.6 m -127.91 137.04 29.95 Favored Pre-proline 0 C--N 1.322 -0.605 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 174.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.497 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 13.6 Cg_exo -68.32 163.15 37.47 Favored 'Trans proline' 0 N--CA 1.463 -0.319 0 C-N-CA 122.124 1.883 . . . . 0.0 111.911 -178.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.524 HD12 ' HB2' ' A' ' 9' ' ' SER . 78.8 mt -79.43 -37.02 38.04 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.359 0.6 . . . . 0.0 110.156 175.078 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 29.7 t70 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.269 -0.872 . . . . 0.0 109.882 177.879 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 36.6 t . . . . . 0 N--CA 1.452 -0.356 0 CA-C-O 120.697 0.284 . . . . 0.0 110.548 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.4 ' O ' HG12 ' A' ' 40' ' ' VAL . 53.5 mtp180 -135.44 161.49 35.32 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.046 0.451 . . . . 0.0 110.839 -176.121 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.535 ' HB2' HD12 ' A' ' 74' ' ' LEU . 19.8 m -118.51 141.83 48.19 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.796 179.011 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.528 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 4.6 m-85 -130.02 133.11 46.52 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.25 -174.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.603 ' HG2' ' HB2' ' A' ' 37' ' ' ALA . 55.7 mtt-85 -89.1 159.03 17.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.071 0.462 . . . . 0.0 110.751 177.092 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 40.0 mt -100.55 111.39 30.09 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.07 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.24 -27.21 53.24 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.458 0.647 . . . . 0.0 110.256 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.568 ' HA2' ' HB3' ' A' ' 34' ' ' PRO . . . 153.61 -149.83 21.4 Favored Glycine 0 N--CA 1.441 -0.975 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.481 -177.498 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.607 ' CE1' ' HG3' ' A' ' 24' ' ' ARG . 19.5 m-85 -118.11 151.62 37.2 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 -179.307 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.523 ' O ' HG22 ' A' ' 19' ' ' ILE . 25.2 m -64.4 143.05 98.48 Favored Pre-proline 0 N--CA 1.447 -0.581 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 178.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 26.0 Cg_exo -62.69 -0.42 1.97 Allowed 'Trans proline' 0 CA--C 1.532 0.424 0 C-N-CA 123.268 2.646 . . . . 0.0 113.901 -173.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.75 -6.59 39.38 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.755 0.312 . . . . 0.0 111.463 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.523 HG22 ' O ' ' A' ' 16' ' ' SER . 12.7 tt -88.01 148.51 4.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 120.974 0.416 . . . . 0.0 110.647 -177.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.511 ' HB3' ' HD2' ' A' ' 23' ' ' TYR . 13.2 t -89.33 162.81 15.62 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.957 179.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -69.71 -40.59 76.17 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 -173.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.39 -33.94 86.43 Favored Glycine 0 CA--C 1.517 0.214 0 C-N-CA 120.422 -0.894 . . . . 0.0 112.037 177.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.511 ' HD2' ' HB3' ' A' ' 20' ' ' SER . 41.1 m-85 -67.15 -38.75 86.05 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 120.782 0.325 . . . . 0.0 110.319 175.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.607 ' HG3' ' CE1' ' A' ' 15' ' ' TYR . 20.2 ttm180 -59.24 -43.34 92.38 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.899 175.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -64.42 -37.14 86.5 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.368 -178.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 62.2 ttt180 -72.38 -36.53 68.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.207 178.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.423 HD23 ' HE3' ' A' ' 30' ' ' MET . 73.8 mt -68.76 -43.37 75.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.411 179.038 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -58.78 -45.39 89.92 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.92 178.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 64.9 m -64.32 -31.6 72.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.588 179.37 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.423 ' HE3' HD23 ' A' ' 27' ' ' LEU . 71.7 mtm -81.33 -15.11 56.34 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.692 -179.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 116.96 6.92 13.43 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.406 -0.902 . . . . 0.0 113.611 174.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.4 mt -105.42 98.02 7.78 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 178.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.437 ' H ' HD23 ' A' ' 33' ' ' LEU . 1.9 pt? -128.95 150.76 76.14 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.258 -174.538 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.568 ' HB3' ' HA2' ' A' ' 14' ' ' GLY . 37.9 Cg_endo -66.23 135.01 38.46 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.807 2.338 . . . . 0.0 111.534 178.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 107.16 -19.73 34.3 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.332 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.32 -171.41 3.56 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-O 121.327 0.584 . . . . 0.0 110.57 -178.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.603 ' HB2' ' HG2' ' A' ' 11' ' ' ARG . . . -148.22 135.9 20.76 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.287 -177.13 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.495 HD13 HG21 ' A' ' 52' ' ' VAL . 51.0 mt -108.8 131.88 54.54 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.159 0.504 . . . . 0.0 110.523 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 6.4 ttp85 -101.94 123.43 45.85 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.321 -0.854 . . . . 0.0 108.831 175.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.608 ' HA ' HG12 ' A' ' 52' ' ' VAL . 10.8 p -69.13 127.2 30.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 121.405 0.622 . . . . 0.0 111.391 -175.308 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.5 t -88.44 -50.64 13.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.761 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.927 174.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 38.9 ttm180 -175.18 142.97 0.65 Allowed 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.192 0.52 . . . . 0.0 112.033 -178.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 98.0 mt -100.86 140.57 19.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 168.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.796 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -82.64 147.93 56.86 Favored Pre-proline 0 C--N 1.324 -0.528 0 O-C-N 122.247 -0.283 . . . . 0.0 111.087 -178.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -67.18 -2.05 7.37 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 123.25 2.633 . . . . 0.0 112.915 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.446 ' HA ' HD22 ' A' ' 46' ' ' LEU . 1.0 OUTLIER -56.57 -38.92 72.63 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 122.153 0.978 . . . . 0.0 109.448 174.921 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.55 ' O ' ' HB2' ' A' ' 48' ' ' ASP . . . 153.18 -55.0 0.44 Allowed Glycine 0 N--CA 1.434 -1.489 0 N-CA-C 108.289 -1.924 . . . . 0.0 108.289 -170.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.55 ' HB2' ' O ' ' A' ' 47' ' ' GLY . 13.0 t70 169.24 120.31 0.04 OUTLIER Pre-proline 0 N--CA 1.452 -0.373 0 O-C-N 125.155 1.15 . . . . 0.0 113.075 168.318 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.796 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 27.8 Cg_endo -109.94 163.53 0.07 OUTLIER 'Trans proline' 0 N--CA 1.433 -2.038 1 C-N-CA 125.307 4.005 . . . . 0.0 108.097 137.324 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.819 HG22 HG13 ' A' ' 52' ' ' VAL . 30.8 mt -115.87 103.97 16.02 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 C-N-CA 119.31 -0.956 . . . . 0.0 110.672 -177.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.462 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 97.9 mt-30 -84.63 113.17 21.08 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 173.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.819 HG13 HG22 ' A' ' 50' ' ' ILE . 15.5 m -132.98 165.68 31.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 120.887 0.375 . . . . 0.0 111.481 -177.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -147.26 141.04 25.72 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.523 -0.918 . . . . 0.0 108.523 176.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 8.9 t -95.89 -47.7 6.03 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.169 -0.612 . . . . 0.0 109.699 176.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 55' ' ' ARG . 13.9 ptt180 177.24 24.04 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.474 0.71 . . . . 0.0 109.554 175.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -127.32 -65.71 0.92 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.082 -172.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.3 t -164.47 153.73 13.47 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.052 -178.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.403 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 10.5 m -71.89 141.39 49.54 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.135 0.493 . . . . 0.0 111.139 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.462 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 65.8 tp -139.9 144.6 37.23 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.031 178.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.419 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -112.56 141.39 46.38 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.605 179.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.59 HD11 HD12 ' A' ' 50' ' ' ILE . 4.0 pp -142.29 161.43 38.05 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 -179.208 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.677 ' HD3' ' OD2' ' A' ' 65' ' ' ASP . 2.8 mpt_? -96.75 175.37 6.39 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.005 0.431 . . . . 0.0 109.979 -177.22 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.1 mmt180 -66.2 -33.52 75.95 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.508 177.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -66.87 -35.3 79.7 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.664 177.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.677 ' OD2' ' HD3' ' A' ' 62' ' ' ARG . 41.4 m-20 -68.23 -42.5 79.64 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-O 121.422 0.629 . . . . 0.0 109.366 175.111 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 45.5 tp -60.21 -32.37 71.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.875 178.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.84 -21.57 66.48 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.453 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 89.6 mt -86.03 -18.61 32.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.92 0.39 . . . . 0.0 110.996 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 88.7 mt -104.39 141.85 35.61 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.709 -177.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 20.2 m -101.29 115.67 31.03 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 172.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 73.2 mt -117.83 147.69 42.81 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.246 -176.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.424 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 4.6 m -128.26 115.33 20.02 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.645 172.287 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.528 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 21.9 Cg_exo -65.31 161.62 36.94 Favored 'Trans proline' 0 N--CA 1.464 -0.251 0 C-N-CA 122.134 1.889 . . . . 0.0 112.323 -177.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.535 HD12 ' HB2' ' A' ' 9' ' ' SER . 97.6 mt -93.56 -15.48 25.4 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 121.341 0.591 . . . . 0.0 109.705 176.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.4 t70 . . . . . 0 C--O 1.244 0.809 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.407 176.739 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.6 t . . . . . 0 N--CA 1.455 -0.181 0 CA-C-O 120.868 0.366 . . . . 0.0 111.079 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -103.71 173.21 6.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.621 0.724 . . . . 0.0 112.057 -172.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.446 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 13.4 t -137.92 140.42 40.3 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.66 172.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.404 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 19.3 m-85 -123.87 129.11 50.47 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.261 -175.424 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.421 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 36.3 mtt-85 -88.96 146.84 24.64 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 177.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.516 HG12 ' CD2' ' A' ' 71' ' ' LEU . 36.7 mt -90.91 111.59 23.88 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 175.429 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 18.5 m -79.08 -22.24 45.58 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.341 0.591 . . . . 0.0 110.336 178.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.655 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 156.94 -142.78 8.96 Favored Glycine 0 N--CA 1.443 -0.873 0 C-N-CA 120.834 -0.698 . . . . 0.0 111.785 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.577 ' HB3' HG21 ' A' ' 19' ' ' ILE . 34.0 m-85 -121.82 151.16 40.92 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.64 ' O ' HG22 ' A' ' 19' ' ' ILE . 74.3 p -69.59 159.16 84.89 Favored Pre-proline 0 N--CA 1.445 -0.68 0 CA-C-O 120.683 0.278 . . . . 0.0 111.002 -177.226 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_exo -73.44 11.57 0.99 Allowed 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 122.533 2.155 . . . . 0.0 111.961 174.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -103.77 -14.26 16.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.766 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.64 HG22 ' O ' ' A' ' 16' ' ' SER . 13.0 tt -89.43 142.96 12.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 120.77 0.319 . . . . 0.0 110.166 179.572 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.7 t -161.36 -174.69 4.41 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.624 0.25 . . . . 0.0 110.368 -174.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.1 t30 59.15 34.91 23.49 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.284 0.634 . . . . 0.0 111.793 174.061 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.39 6.0 87.84 Favored Glycine 0 CA--C 1.519 0.293 0 C-N-CA 120.838 -0.696 . . . . 0.0 114.011 174.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -62.22 -22.83 66.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 117.31 0.555 . . . . 0.0 110.889 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.494 ' HG2' ' CG ' ' A' ' 15' ' ' TYR . 34.6 mtt85 -63.95 -42.84 97.18 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.746 174.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -66.88 -35.79 80.83 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 121.231 0.539 . . . . 0.0 109.802 177.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 86.1 mtt180 -62.13 -44.14 97.28 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.814 176.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.612 HD22 HD12 ' A' ' 32' ' ' LEU . 38.2 mt -69.56 -41.71 75.5 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.493 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -58.14 -47.44 83.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.415 178.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 59.3 m -63.34 -28.68 70.17 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.571 -179.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.422 ' HE3' HD23 ' A' ' 27' ' ' LEU . 67.9 mtm -84.71 -12.99 52.68 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.424 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 114.76 -0.28 23.1 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.471 -0.871 . . . . 0.0 113.261 174.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.821 HD13 HD11 ' A' ' 69' ' ' LEU . 88.7 mt -96.05 100.44 12.1 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.968 0.413 . . . . 0.0 110.107 -178.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 pp -138.89 155.42 73.09 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.069 -175.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.655 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 23.0 Cg_exo -64.4 137.61 56.39 Favored 'Trans proline' 0 C--O 1.234 0.308 0 C-N-CA 122.9 2.4 . . . . 0.0 112.052 179.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 111.04 -28.12 10.14 Favored Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.313 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.03 154.08 21.04 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-O 121.122 0.486 . . . . 0.0 110.105 -179.041 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.421 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -129.94 138.17 50.74 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.973 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.65 ' HB3' ' HB ' ' A' ' 52' ' ' VAL . 2.2 mm? -106.87 142.19 36.9 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.268 179.803 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 35.5 ttt180 -94.16 132.85 38.28 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 173.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.591 ' HA ' HG12 ' A' ' 52' ' ' VAL . 7.6 p -71.64 128.28 34.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.157 0.504 . . . . 0.0 111.084 -175.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.0 t -99.35 -44.87 11.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.611 176.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 57.9 ttt180 -176.52 135.79 0.25 Allowed 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 -177.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.424 HG23 ' HD2' ' A' ' 49' ' ' PRO . 4.8 mp -116.6 128.76 73.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 166.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.428 ' H ' ' CD ' ' A' ' 49' ' ' PRO . . . -67.12 125.49 91.05 Favored Pre-proline 0 C--N 1.32 -0.675 0 C-N-CA 121.048 -0.261 . . . . 0.0 110.442 176.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -57.36 -14.45 15.98 Favored 'Trans proline' 0 N--CA 1.475 0.428 0 C-N-CA 123.426 2.751 . . . . 0.0 113.107 -179.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -54.92 -33.24 61.95 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.315 176.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 164.37 -75.64 0.16 Allowed Glycine 0 N--CA 1.435 -1.419 0 N-CA-C 110.981 -0.848 . . . . 0.0 110.981 -177.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -164.68 118.53 0.99 Allowed Pre-proline 0 N--CA 1.443 -0.818 0 N-CA-C 114.522 1.304 . . . . 0.0 114.522 179.364 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.428 ' CD ' ' H ' ' A' ' 44' ' ' ALA . 82.3 Cg_endo -118.61 -175.5 0.02 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.714 1 C-N-CA 126.994 5.129 . . . . 0.0 107.988 132.738 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.509 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 67.3 mt -145.11 104.43 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.237 0 C-N-CA 120.117 -0.633 . . . . 0.0 109.882 173.253 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.443 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 8.9 tt0 -92.96 120.64 33.49 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 174.233 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.65 ' HB ' ' HB3' ' A' ' 38' ' ' LEU . 7.6 m -140.53 162.02 23.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.777 0.322 . . . . 0.0 111.025 -176.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -119.12 135.61 54.57 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.024 -0.534 . . . . 0.0 109.689 -178.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.0 t -88.91 -33.12 17.4 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.704 -0.399 . . . . 0.0 110.044 179.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 35.1 ttm180 178.24 -61.25 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.308 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -107.31 -38.33 5.99 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.513 178.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.0 t -109.0 150.2 28.1 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.901 0.381 . . . . 0.0 110.845 -174.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.2 p -114.38 144.91 42.53 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.649 179.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.443 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 6.2 mp -127.45 162.01 27.38 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.987 -176.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.509 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -131.41 142.18 49.98 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.858 177.097 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.498 HD13 ' HB2' ' A' ' 65' ' ' ASP . 3.9 pp -153.82 177.34 11.11 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 -174.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.409 ' HD2' ' O ' ' A' ' 61' ' ' LEU . 15.1 mmm-85 -121.92 -175.04 3.02 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.931 0.872 . . . . 0.0 111.521 -178.673 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.0 ptp180 -56.04 -34.0 65.47 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 113.757 -1.565 . . . . 0.0 111.669 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -63.11 -44.61 95.15 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.478 179.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.498 ' HB2' HD13 ' A' ' 61' ' ' LEU . 7.7 m-20 -67.63 -39.45 84.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.246 0.546 . . . . 0.0 109.601 178.122 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 66.3 tp -60.03 -39.64 86.58 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.289 -0.868 . . . . 0.0 110.878 177.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.45 -12.84 61.61 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.231 -0.441 . . . . 0.0 112.118 -176.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.497 ' HB3' HD12 ' A' ' 19' ' ' ILE . 93.8 mt -93.32 -21.33 19.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.79 0.329 . . . . 0.0 110.81 179.459 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.821 HD11 HD13 ' A' ' 32' ' ' LEU . 96.9 mt -107.25 140.32 40.32 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.463 -175.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.5 m -91.27 112.29 24.14 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 169.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.516 ' CD2' HG12 ' A' ' 12' ' ' ILE . 82.6 mt -120.92 128.05 52.41 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.307 -174.485 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.417 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 34.9 m -124.93 133.03 24.45 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.119 176.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 72' ' ' VAL . 18.5 Cg_exo -65.04 163.29 29.2 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.087 1.858 . . . . 0.0 111.414 179.223 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 9' ' ' SER . 91.3 mt -53.81 -57.62 10.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.216 0.531 . . . . 0.0 109.714 173.562 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.6 t70 . . . . . 0 C--O 1.251 1.132 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.416 176.413 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.0 t . . . . . 0 N--CA 1.451 -0.414 0 CA-C-O 120.765 0.317 . . . . 0.0 111.597 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 47.8 ttt85 -111.12 144.57 40.05 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.56 -171.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.1 t -123.21 139.78 53.7 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.925 -178.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.648 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 8.3 m-85 -116.66 133.19 56.31 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -178.307 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.456 ' CZ ' HD23 ' A' ' 74' ' ' LEU . 11.2 ptp180 -102.73 157.91 16.62 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 175.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.493 HG12 ' CD2' ' A' ' 71' ' ' LEU . 19.6 mt -104.66 115.04 45.81 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.131 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.018 -178.381 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 1.5 p -93.05 -16.27 25.19 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.664 0.269 . . . . 0.0 111.255 178.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.541 ' HA2' ' HB3' ' A' ' 34' ' ' PRO . . . 165.13 -153.84 24.24 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.487 -0.863 . . . . 0.0 112.28 178.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.52 ' CE1' ' HD3' ' A' ' 34' ' ' PRO . 60.9 m-85 -119.86 153.32 36.0 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 -178.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.591 ' O ' HG22 ' A' ' 19' ' ' ILE . 29.2 m -67.89 138.47 92.85 Favored Pre-proline 0 N--CA 1.441 -0.875 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 176.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -65.98 6.82 0.42 Allowed 'Trans proline' 0 CA--C 1.532 0.415 0 C-N-CA 122.771 2.314 . . . . 0.0 113.481 -175.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -106.39 7.77 31.29 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.705 179.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.591 HG22 ' O ' ' A' ' 16' ' ' SER . 13.5 tt -96.97 132.87 40.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 CA-C-O 121.034 0.445 . . . . 0.0 110.464 177.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.9 t -156.75 -161.54 1.11 Allowed 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 -176.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 67.51 16.55 9.96 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.652 0.739 . . . . 0.0 110.924 175.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 79.69 4.05 89.23 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.51 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -66.11 -27.67 68.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.223 0.535 . . . . 0.0 110.245 -178.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 27.4 ttm180 -64.02 -41.95 97.27 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.023 176.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -69.69 -32.86 71.71 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.508 177.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -64.08 -43.33 95.75 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.997 0.427 . . . . 0.0 109.969 175.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.565 HD22 HD12 ' A' ' 32' ' ' LEU . 57.8 mt -64.3 -45.69 86.87 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.092 176.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -56.69 -45.33 81.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.417 178.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 48.8 m -63.19 -33.38 75.34 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.048 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 71.5 mtm -81.79 -10.44 59.34 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.434 -179.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 108.1 5.0 33.2 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.661 -0.78 . . . . 0.0 113.138 174.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.595 HD13 HD11 ' A' ' 69' ' ' LEU . 97.5 mt -94.0 91.0 6.66 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 177.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.8 pp -135.75 157.85 75.32 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.336 -174.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.541 ' HB3' ' HA2' ' A' ' 14' ' ' GLY . 32.3 Cg_endo -65.69 124.01 12.18 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.698 2.265 . . . . 0.0 111.627 177.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.56 -7.41 17.95 Favored Glycine 0 N--CA 1.444 -0.819 0 C-N-CA 120.818 -0.706 . . . . 0.0 111.843 -176.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -97.27 -172.52 2.44 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-O 120.985 0.422 . . . . 0.0 110.553 178.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.452 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -160.13 149.71 17.86 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.654 -176.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 58.8 mt -125.22 138.53 54.12 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.781 178.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 36.9 ttp180 -111.5 124.22 51.84 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 176.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.555 ' HA ' HG12 ' A' ' 52' ' ' VAL . 7.4 p -61.58 127.79 21.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-O 121.109 0.481 . . . . 0.0 112.11 -174.458 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 92.7 t -102.71 -50.9 9.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.917 171.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.402 ' HG3' ' HB2' ' A' ' 51' ' ' GLN . 5.9 ptm180 -170.67 161.05 7.37 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.122 0.487 . . . . 0.0 111.785 -178.696 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 82.5 mt -135.1 143.19 37.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 171.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.761 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -69.13 142.34 92.78 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 117.88 0.309 . . . . 0.0 110.841 179.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 22.7 Cg_exo -66.06 -8.92 21.52 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 123.184 2.589 . . . . 0.0 113.25 -177.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.419 HD13 ' HA ' ' A' ' 46' ' ' LEU . 4.0 mm? -65.86 -88.48 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.643 0.735 . . . . 0.0 110.443 176.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -123.95 -74.53 0.27 Allowed Glycine 0 CA--C 1.491 -1.444 0 N-CA-C 109.425 -1.47 . . . . 0.0 109.425 172.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.442 ' OD2' ' HB3' ' A' ' 63' ' ' ARG . 4.9 p-10 -178.44 124.41 0.26 Allowed Pre-proline 0 N--CA 1.44 -0.955 0 N-CA-C 113.995 1.109 . . . . 0.0 113.995 174.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.761 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 15.1 Cg_endo -105.45 157.82 0.16 Allowed 'Trans proline' 0 N--CA 1.437 -1.812 0 C-N-CA 125.005 3.803 . . . . 0.0 107.458 136.539 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.625 HG22 HG13 ' A' ' 52' ' ' VAL . 4.5 mp -119.8 104.88 16.29 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.706 0 C-N-CA 118.988 -1.085 . . . . 0.0 110.365 -175.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.434 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 26.1 mp0 -88.65 117.85 27.9 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.078 174.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.625 HG13 HG22 ' A' ' 50' ' ' ILE . 14.1 m -132.94 172.44 16.46 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.51 -178.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.572 ' HG2' ' H ' ' A' ' 55' ' ' ARG . 34.0 tt0 -117.58 130.83 56.64 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.004 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 17.8 p -92.53 17.89 9.41 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.088 -179.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.572 ' H ' ' HG2' ' A' ' 53' ' ' GLU . 0.0 OUTLIER 63.32 21.09 12.63 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.818 0.818 . . . . 0.0 109.005 -173.935 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -141.72 -62.37 0.46 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.993 -1.003 . . . . 0.0 108.512 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.7 t -142.92 174.72 10.42 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.679 178.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 17.8 m -82.49 143.45 31.11 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.99 0.424 . . . . 0.0 110.331 178.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.434 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 43.8 tp -134.14 144.62 48.65 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.572 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.539 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -133.07 139.72 47.3 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.74 -0.663 . . . . 0.0 109.574 177.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.0 pp -154.84 178.81 9.73 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -176.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 25.6 mmt85 -115.73 170.55 8.37 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 121.92 0.866 . . . . 0.0 112.206 -178.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.442 ' HB3' ' OD2' ' A' ' 48' ' ' ASP . 13.1 ptt-85 -62.14 -36.15 80.91 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 113.611 -1.631 . . . . 0.0 111.766 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.428 ' HE3' ' HB3' ' A' ' 64' ' ' LYS . 1.3 tmmt? -58.16 -45.85 86.74 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.923 0.392 . . . . 0.0 110.624 178.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -71.74 -37.75 70.52 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.324 0.583 . . . . 0.0 110.137 178.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 18.7 tp -64.12 -33.25 75.34 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.78 -179.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.27 -18.37 63.13 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.777 -178.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.438 ' HB3' HD12 ' A' ' 19' ' ' ILE . 91.2 mt -88.76 -7.49 56.14 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.757 0.313 . . . . 0.0 110.959 -179.701 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.595 HD11 HD13 ' A' ' 32' ' ' LEU . 94.7 mt -103.49 141.75 35.46 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.545 178.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 25.1 m -96.77 114.52 26.16 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 172.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.493 ' CD2' HG12 ' A' ' 12' ' ' ILE . 74.5 mt -121.79 134.98 54.91 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.047 -172.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.446 ' O ' ' HG2' ' A' ' 11' ' ' ARG . 17.1 m -127.61 128.48 23.94 Favored Pre-proline 0 C--N 1.319 -0.725 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 170.573 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.648 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 36.9 Cg_endo -65.63 163.4 30.36 Favored 'Trans proline' 0 C--O 1.234 0.29 0 C-N-CA 122.526 2.151 . . . . 0.0 113.545 -173.231 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.456 HD23 ' CZ ' ' A' ' 11' ' ' ARG . 95.7 mt -94.63 -71.77 0.65 Allowed 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.292 -0.867 . . . . 0.0 108.708 173.125 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 . . . . . 0 C--O 1.253 1.249 0 CA-C-O 117.748 -1.12 . . . . 0.0 109.304 175.603 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 23.4 t . . . . . 0 N--CA 1.448 -0.532 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.407 ' H ' HG12 ' A' ' 40' ' ' VAL . 88.3 mtt180 -149.34 153.47 37.5 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 120.857 0.36 . . . . 0.0 110.775 177.02 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.514 ' HB2' HD12 ' A' ' 74' ' ' LEU . 2.2 m -95.79 135.56 37.35 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.921 179.414 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.542 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 44.8 m-85 -113.97 141.09 47.83 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.213 -177.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.53 ' HD2' HD23 ' A' ' 74' ' ' LEU . 45.4 mtp180 -97.96 144.94 26.98 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 178.652 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.439 HG12 ' CD2' ' A' ' 71' ' ' LEU . 18.7 mt -99.02 113.67 34.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 177.235 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 12.6 p -102.0 -3.63 27.4 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -175.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.491 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 160.46 -161.73 32.84 Favored Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 119.946 -1.121 . . . . 0.0 112.445 175.541 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -118.93 156.61 29.25 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 36.9 t -66.1 137.36 95.74 Favored Pre-proline 0 C--N 1.319 -0.726 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 170.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -59.22 -14.81 25.77 Favored 'Trans proline' 0 CA--C 1.529 0.272 0 C-N-CA 122.838 2.359 . . . . 0.0 112.867 -176.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -78.3 -8.59 58.57 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.746 -178.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 15.7 tt -63.16 129.12 26.29 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-O 121.163 0.506 . . . . 0.0 110.523 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.3 t -134.21 178.16 7.19 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.318 -172.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 58.58 -158.99 0.29 Allowed 'General case' 0 CA--C 1.534 0.352 0 O-C-N 123.651 0.594 . . . . 0.0 109.59 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -94.09 25.62 21.11 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.817 -0.706 . . . . 0.0 111.782 176.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.447 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 4.9 t80 -64.48 -32.3 73.87 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.024 0.44 . . . . 0.0 110.154 -177.483 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 14.4 ttm180 -58.9 -42.11 88.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.464 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -65.61 -39.73 91.85 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.409 -179.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 34.1 ttt180 -66.17 -39.49 89.79 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.972 178.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 23' ' ' TYR . 85.2 mt -66.83 -44.3 81.44 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.349 179.298 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -57.62 -44.75 85.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.115 177.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 47.2 m -63.21 -34.17 77.06 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.172 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.525 ' HA ' ' CE ' ' A' ' 30' ' ' MET . 15.9 mmt -74.34 -24.67 59.22 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.848 -179.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.06 6.04 14.35 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.498 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.677 HD13 HD11 ' A' ' 69' ' ' LEU . 68.7 mt -97.66 90.86 5.15 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.2 pp -141.29 155.15 67.95 Favored Pre-proline 0 C--N 1.322 -0.604 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.065 -174.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.491 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 24.0 Cg_exo -63.72 127.05 18.71 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.815 2.343 . . . . 0.0 111.931 178.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.64 5.67 44.86 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.081 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -107.52 -179.45 3.92 Favored 'General case' 0 N--CA 1.442 -0.853 0 CA-C-O 120.968 0.413 . . . . 0.0 109.957 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -148.55 145.59 27.92 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.093 -177.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.471 HD13 HG21 ' A' ' 52' ' ' VAL . 45.6 mt -129.39 131.12 46.74 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.45 177.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.476 ' HA ' ' HA ' ' A' ' 9' ' ' SER . 38.3 ttm180 -100.61 118.84 37.58 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.222 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.634 ' HA ' HG12 ' A' ' 52' ' ' VAL . 7.5 p -65.32 131.09 31.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.56 0.695 . . . . 0.0 111.506 -174.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.754 HG12 ' HG3' ' A' ' 42' ' ' ARG . 59.2 t -95.84 -54.97 6.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.942 174.111 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.754 ' HG3' HG12 ' A' ' 41' ' ' VAL . 54.9 mtp180 -155.23 143.49 20.24 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -176.168 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.432 HG23 ' HD2' ' A' ' 49' ' ' PRO . 4.7 mp -114.87 119.43 61.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 161.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.417 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -56.91 127.87 75.77 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-O 120.525 0.202 . . . . 0.0 111.129 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 38.4 Cg_exo -62.33 -8.56 12.83 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 123.415 2.743 . . . . 0.0 112.61 -179.18 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -56.24 -38.36 70.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.554 173.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 170.52 -77.01 0.1 OUTLIER Glycine 0 N--CA 1.438 -1.172 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 -176.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -169.85 120.74 0.58 Allowed Pre-proline 0 N--CA 1.452 -0.361 0 CA-C-O 122.257 1.027 . . . . 0.0 113.666 177.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.432 ' HD2' HG23 ' A' ' 43' ' ' ILE . 89.7 Cg_endo -117.96 -166.79 0.01 OUTLIER 'Trans proline' 0 N--CA 1.438 -1.786 1 C-N-CA 126.337 4.691 . . . . 0.0 107.777 139.206 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.741 HG22 HG13 ' A' ' 52' ' ' VAL . 54.5 mt -143.8 101.9 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.239 0 C-N-CA 120.255 -0.578 . . . . 0.0 109.628 168.124 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.514 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 54.2 mt-30 -87.91 119.09 27.93 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 175.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.741 HG13 HG22 ' A' ' 50' ' ' ILE . 17.7 m -132.68 171.88 17.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 120.802 0.335 . . . . 0.0 111.56 -175.379 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.498 ' HG3' ' H ' ' A' ' 55' ' ' ARG . 10.1 tp10 -138.82 141.19 38.71 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 176.201 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.1 t -124.13 18.53 9.16 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.639 0.733 . . . . 0.0 109.644 -176.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.498 ' H ' ' HG3' ' A' ' 53' ' ' GLU . 74.6 mtm180 74.52 23.7 1.87 Allowed 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.66 178.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -140.91 -52.92 0.47 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.275 0.56 . . . . 0.0 110.062 -178.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 59.9 m -153.84 135.67 14.54 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.472 -0.785 . . . . 0.0 109.428 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.5 m -76.65 131.52 38.89 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 175.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.514 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 3.0 mm? -121.64 171.75 8.61 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.98 0.419 . . . . 0.0 111.495 -176.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.539 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -146.25 141.79 27.72 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 174.172 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.458 ' C ' ' HD2' ' A' ' 62' ' ' ARG . 4.1 pp -146.18 155.45 42.72 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 120.693 -0.403 . . . . 0.0 110.167 -173.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.603 ' N ' ' HD2' ' A' ' 62' ' ' ARG . 4.2 mpt_? -104.39 164.79 11.49 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.585 -178.085 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.403 ' HA ' ' HB3' ' A' ' 66' ' ' LEU . 45.5 mtm180 -50.76 -36.05 34.8 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 114.858 -1.065 . . . . 0.0 112.925 -178.553 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -59.19 -49.33 78.26 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.761 0.315 . . . . 0.0 110.824 178.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -72.39 -34.37 67.88 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.035 0.445 . . . . 0.0 110.194 178.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.408 HD13 HD12 ' A' ' 50' ' ' ILE . 62.6 tp -62.71 -37.05 84.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.005 178.213 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.71 -18.56 65.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.731 -178.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 96.0 mt -94.77 -4.59 47.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.566 -178.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.677 HD11 HD13 ' A' ' 32' ' ' LEU . 92.1 mt -111.5 129.24 56.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.778 0.323 . . . . 0.0 111.521 -176.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.9 m -88.55 115.95 26.44 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 172.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.439 ' CD2' HG12 ' A' ' 12' ' ' ILE . 70.5 mt -124.93 135.33 52.74 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.021 -174.489 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 24.1 m -133.76 132.64 21.7 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.455 173.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.542 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 17.1 Cg_exo -66.07 164.05 29.06 Favored 'Trans proline' 0 CA--C 1.533 0.427 0 C-N-CA 122.48 2.12 . . . . 0.0 113.196 -175.398 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.53 HD23 ' HD2' ' A' ' 11' ' ' ARG . 39.2 mt -67.69 -26.32 66.12 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.207 175.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 37.1 t70 . . . . . 0 C--O 1.248 1.001 0 O-C-N 124.102 0.876 . . . . 0.0 110.707 -178.186 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.2 t . . . . . 0 N--CA 1.454 -0.244 0 CA-C-O 120.519 0.199 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -95.93 169.95 9.63 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.441 0.639 . . . . 0.0 111.78 -175.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.573 ' HB3' HD12 ' A' ' 74' ' ' LEU . 23.4 t -140.29 140.28 35.66 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 114.994 -1.003 . . . . 0.0 109.483 176.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.585 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 15.0 m-85 -121.14 128.33 52.43 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 -178.17 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.467 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 67.6 mtp180 -97.81 149.87 21.88 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.515 178.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 25.5 mt -88.08 117.2 31.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 8.8 t -94.8 -18.47 21.2 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.944 0.402 . . . . 0.0 110.271 -179.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 166.89 -161.66 35.46 Favored Glycine 0 N--CA 1.443 -0.849 0 C-N-CA 120.449 -0.881 . . . . 0.0 112.269 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -105.81 158.35 16.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.677 0.275 . . . . 0.0 110.446 -178.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.459 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 31.3 t -52.05 134.24 39.69 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.945 175.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 17.7 Cg_exo -67.77 2.53 2.44 Favored 'Trans proline' 0 C--O 1.235 0.374 0 C-N-CA 122.954 2.436 . . . . 0.0 112.649 178.5 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -115.52 6.7 14.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.916 178.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.457 HG22 ' O ' ' A' ' 16' ' ' SER . 10.8 tt -87.9 150.48 3.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.908 0.385 . . . . 0.0 110.812 -177.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 35.4 t -89.67 158.69 17.47 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.156 178.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.459 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 15.0 m120 -54.95 -44.3 74.2 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.237 -179.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.1 -36.67 92.22 Favored Glycine 0 C--N 1.329 0.173 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.833 -176.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -72.71 -31.19 64.82 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.435 ' HB3' ' O ' ' A' ' 21' ' ' ASN . 12.8 ttt180 -62.0 -43.79 98.1 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.746 172.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.459 ' HG3' ' O ' ' A' ' 21' ' ' ASN . 28.1 mt-30 -61.1 -41.88 97.48 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.565 177.182 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -57.83 -48.53 79.51 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.326 175.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.53 HD22 HD12 ' A' ' 32' ' ' LEU . 41.2 mt -67.55 -40.15 84.99 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.682 -176.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -60.34 -46.14 90.95 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.026 178.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 46.1 m -65.99 -31.49 72.42 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.141 179.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 82.5 mtp -71.03 -24.52 62.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.536 177.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 112.39 6.54 23.62 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.89 -0.671 . . . . 0.0 112.184 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.573 HD13 HD11 ' A' ' 69' ' ' LEU . 85.8 mt -98.31 97.3 8.69 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.989 0.423 . . . . 0.0 110.051 -178.272 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.4 pp -142.06 157.6 63.5 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.871 -176.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.66 139.38 88.59 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.731 2.287 . . . . 0.0 112.357 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 112.07 -21.07 20.87 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.328 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -85.53 -177.51 6.45 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 121.048 0.452 . . . . 0.0 110.35 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.467 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -159.65 134.93 8.22 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.91 -176.369 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.462 ' N ' HD22 ' A' ' 38' ' ' LEU . 2.2 mm? -108.55 141.18 40.85 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.622 176.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 20.5 ttm180 -109.09 127.72 54.38 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 176.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.572 ' HA ' HG12 ' A' ' 52' ' ' VAL . 9.9 p -67.27 127.71 29.29 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-O 121.309 0.576 . . . . 0.0 111.662 -172.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.8 t -106.73 -50.68 7.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.703 173.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.422 ' HE ' ' HB3' ' A' ' 42' ' ' ARG . 1.1 mtp180 -156.92 159.66 38.34 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -174.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.419 HG23 ' HD2' ' A' ' 49' ' ' PRO . 80.0 mt -127.45 142.53 43.33 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 162.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.646 ' H ' ' CD ' ' A' ' 49' ' ' PRO . . . -84.14 140.27 39.65 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-O 120.554 0.216 . . . . 0.0 111.523 -177.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -65.8 -7.39 16.5 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 123.107 2.538 . . . . 0.0 112.152 176.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.598 HD13 ' HB1' ' A' ' 44' ' ' ALA . 10.0 mp -57.76 -28.82 64.29 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.752 0.787 . . . . 0.0 110.336 173.36 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 153.95 -76.97 0.21 Allowed Glycine 0 N--CA 1.432 -1.633 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 -175.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -170.92 124.2 0.59 Allowed Pre-proline 0 N--CA 1.435 -1.195 0 CA-C-O 122.321 1.057 . . . . 0.0 113.094 174.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.646 ' CD ' ' H ' ' A' ' 44' ' ' ALA . 97.9 Cg_endo -115.04 -162.16 0.02 OUTLIER 'Trans proline' 0 N--CA 1.432 -2.146 1 C-N-CA 125.749 4.299 . . . . 0.0 107.686 143.3 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.791 HG22 HG13 ' A' ' 52' ' ' VAL . 52.5 mt -141.83 102.63 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.282 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 166.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -79.23 118.73 21.43 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 177.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.791 HG13 HG22 ' A' ' 50' ' ' ILE . 17.3 m -136.87 173.7 13.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-O 120.808 0.337 . . . . 0.0 111.313 -176.184 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -124.66 142.99 50.98 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 176.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 8.6 m -110.31 -39.25 5.02 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.683 -177.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 16.0 ptt180 179.46 -45.38 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.099 -0.5 . . . . 0.0 112.031 -177.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -132.27 -14.1 3.01 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -171.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.8 t -156.19 129.95 8.43 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.078 0.466 . . . . 0.0 110.279 -175.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.8 m -76.68 138.14 39.83 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.64 -177.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 16.6 mt -126.89 174.56 8.72 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.222 -175.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.457 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -134.78 161.24 35.73 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.35 178.392 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.786 HD11 HD12 ' A' ' 50' ' ' ILE . 4.2 pp -151.43 158.68 44.0 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 179.127 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.648 ' N ' ' HD2' ' A' ' 62' ' ' ARG . 6.3 mpt_? -109.32 176.35 5.12 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 -175.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -61.73 -38.27 87.28 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.032 178.359 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.449 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 55.0 tptt -64.53 -49.3 71.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.278 176.322 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -61.88 -39.33 91.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.587 179.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 55.6 tp -63.33 -37.82 88.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.817 178.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.66 -10.9 60.48 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.557 -178.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 64' ' ' LYS . 77.3 mt -87.07 -23.41 24.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.739 0.304 . . . . 0.0 111.05 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.573 HD11 HD13 ' A' ' 32' ' ' LEU . 95.7 mt -113.97 135.38 54.06 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.584 -178.64 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.9 m -90.4 115.85 27.89 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 174.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 80.2 mt -110.85 133.48 53.33 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.951 -175.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.3 m -114.55 114.87 44.71 Favored Pre-proline 0 C--N 1.319 -0.728 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.369 172.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.585 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 39.6 Cg_endo -68.31 163.0 38.05 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 121.988 1.792 . . . . 0.0 112.087 -177.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.573 HD12 ' HB3' ' A' ' 9' ' ' SER . 80.0 mt -76.28 1.76 15.17 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.412 175.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 32.5 t70 . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.408 -0.806 . . . . 0.0 109.808 178.131 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 18.9 t . . . . . 0 N--CA 1.447 -0.603 0 CA-C-O 120.454 0.169 . . . . 0.0 110.58 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.408 ' O ' HG12 ' A' ' 40' ' ' VAL . 86.8 mtt-85 -143.99 -174.91 4.4 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 121.108 0.48 . . . . 0.0 111.178 -172.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.466 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 17.8 m -101.44 144.97 29.58 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.083 -178.194 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.766 ' HE2' ' HB ' ' A' ' 40' ' ' VAL . 39.1 m-85 -121.61 128.13 51.61 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 177.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.493 ' HG2' ' HB2' ' A' ' 37' ' ' ALA . 98.3 mtt180 -90.25 155.81 18.74 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.569 -0.452 . . . . 0.0 110.584 178.349 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.7 mt -105.77 111.47 35.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.829 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 3.0 p -81.14 -21.3 39.91 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.896 0.379 . . . . 0.0 110.822 179.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.54 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 159.51 -144.49 10.23 Favored Glycine 0 N--CA 1.439 -1.11 0 C-N-CA 120.109 -1.044 . . . . 0.0 112.134 177.331 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.474 ' CB ' HG21 ' A' ' 19' ' ' ILE . 21.3 m-85 -123.96 157.82 33.47 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -177.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.487 ' O ' HG22 ' A' ' 19' ' ' ILE . 20.4 m -59.49 134.98 88.86 Favored Pre-proline 0 N--CA 1.447 -0.592 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 172.202 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 85.6 Cg_exo -48.05 -29.78 12.87 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 123.723 2.949 . . . . 0.0 114.736 -173.149 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -88.18 10.51 19.18 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -174.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.487 HG22 ' O ' ' A' ' 16' ' ' SER . 17.2 tt -77.71 114.74 18.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.492 0.663 . . . . 0.0 109.991 176.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.53 ' O ' ' HB2' ' A' ' 21' ' ' ASN . 65.4 m -165.83 99.17 0.66 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.825 -172.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.53 ' HB2' ' O ' ' A' ' 20' ' ' SER . 3.7 t30 171.37 33.27 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 177.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 73.47 -1.15 45.2 Favored Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.149 -173.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -60.55 -32.26 71.34 Favored 'General case' 0 C--N 1.334 -0.075 0 CA-C-O 120.774 0.321 . . . . 0.0 111.066 -175.578 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 11.8 mtp180 -62.27 -41.87 98.84 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.723 176.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -67.76 -34.69 77.31 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 120.963 0.411 . . . . 0.0 110.301 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.462 ' HA ' ' HD2' ' A' ' 26' ' ' ARG . 16.5 tpt180 -64.26 -42.91 96.25 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.771 -0.65 . . . . 0.0 109.978 176.028 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.637 HD13 HD21 ' A' ' 69' ' ' LEU . 90.6 mt -70.36 -38.08 74.71 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.504 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -59.53 -40.51 87.41 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.792 175.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 50.3 m -67.85 -33.23 74.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.838 179.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.544 ' HA ' ' CE ' ' A' ' 30' ' ' MET . 10.6 mmt -73.7 -23.17 59.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.868 178.39 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 109.28 12.67 19.29 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.894 -0.669 . . . . 0.0 112.343 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.4 mt -101.32 95.51 6.56 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.888 0.375 . . . . 0.0 110.325 -179.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.405 ' H ' HD23 ' A' ' 33' ' ' LEU . 1.9 pt? -130.88 154.74 82.02 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.288 -177.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.54 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 27.9 Cg_exo -61.48 119.49 6.66 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.722 2.281 . . . . 0.0 111.713 178.041 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.75 -7.12 17.68 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.773 -0.727 . . . . 0.0 111.996 -177.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -94.33 -171.96 2.66 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 120.984 0.421 . . . . 0.0 110.192 178.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.493 ' HB2' ' HG2' ' A' ' 11' ' ' ARG . . . -155.22 148.13 24.51 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.714 -177.014 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.571 HD13 HG21 ' A' ' 52' ' ' VAL . 33.0 mt -125.52 132.63 52.58 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 178.595 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 42.9 ttp180 -98.27 124.23 42.78 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 178.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.766 ' HB ' ' HE2' ' A' ' 10' ' ' TYR . 8.1 p -69.1 126.09 28.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.344 0.592 . . . . 0.0 111.416 -174.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 65.2 t -97.44 -44.58 12.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.353 177.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 78.8 ttt180 -165.41 135.55 3.64 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.868 0.366 . . . . 0.0 111.551 176.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.7 mp -90.77 129.33 41.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 172.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.436 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -64.62 131.45 95.12 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-O 120.656 0.265 . . . . 0.0 110.385 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 44.5 Cg_exo -58.31 -18.6 38.77 Favored 'Trans proline' 0 CA--C 1.532 0.404 0 C-N-CA 123.236 2.624 . . . . 0.0 113.093 -177.258 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -88.42 -20.46 25.22 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.334 -177.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 101.29 -13.56 58.48 Favored Glycine 0 C--O 1.235 0.177 0 N-CA-C 111.212 -0.755 . . . . 0.0 111.212 -173.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.583 ' CB ' ' HD2' ' A' ' 49' ' ' PRO . 0.5 OUTLIER -62.72 169.21 3.48 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 114.986 -0.607 . . . . 0.0 110.522 172.706 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.583 ' HD2' ' CB ' ' A' ' 48' ' ' ASP . 12.0 Cg_exo -29.07 151.68 0.01 OUTLIER 'Trans proline' 0 C--N 1.361 1.217 1 C-N-CA 125.335 4.024 . . . . 0.0 116.059 -170.786 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.504 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 60.0 mt -110.83 133.72 55.41 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 113.87 -1.514 . . . . 0.0 109.734 -173.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 -84.83 118.87 24.74 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.304 -179.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.571 HG21 HD13 ' A' ' 38' ' ' LEU . 27.6 m -128.92 167.12 24.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.1 178.337 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -129.29 151.0 50.42 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 -177.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 18.4 p -119.46 -64.28 1.29 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.627 -179.139 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.426 HH11 ' HD3' ' A' ' 55' ' ' ARG . 38.7 ttp180 -168.62 18.45 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.57 -176.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -148.29 -51.28 0.17 Allowed 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -172.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.4 t -173.02 167.2 5.01 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 -175.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.424 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 1.8 p -81.76 126.35 31.72 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.293 0.568 . . . . 0.0 111.417 -176.425 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 53.0 tp -118.87 147.22 44.2 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.79 -178.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.566 ' HB1' ' HB2' ' A' ' 49' ' ' PRO . . . -110.93 127.14 55.38 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.752 0.311 . . . . 0.0 110.602 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.7 pp -103.59 132.78 49.55 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.709 ' HD3' ' OD2' ' A' ' 65' ' ' ASP . 0.5 OUTLIER -75.49 174.45 9.63 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.069 0.461 . . . . 0.0 111.136 -170.715 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 23.0 mmm180 -62.19 -33.55 74.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.177 174.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -62.14 -52.75 62.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.841 177.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.709 ' OD2' ' HD3' ' A' ' 62' ' ' ARG . 33.4 m-20 -63.01 -41.99 99.7 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.087 -179.198 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 54.1 tp -60.18 -38.49 83.39 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.799 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.31 -15.76 62.42 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.953 0.406 . . . . 0.0 111.404 -179.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 94.4 mt -108.25 -4.32 17.65 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.383 -179.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.637 HD21 HD13 ' A' ' 27' ' ' LEU . 82.7 mt -110.67 134.82 52.11 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.778 0.323 . . . . 0.0 110.95 -179.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 32.2 m -106.58 116.9 32.73 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.213 0.53 . . . . 0.0 110.287 174.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.8 mp -124.62 150.49 45.96 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.696 -177.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 16.9 m -130.33 123.21 20.42 Favored Pre-proline 0 C--N 1.319 -0.731 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 175.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.46 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 36.2 Cg_endo -66.48 164.15 29.74 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.031 1.821 . . . . 0.0 111.601 179.032 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 9' ' ' SER . 91.1 mt -54.59 -40.88 69.27 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.796 172.35 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 22.8 t70 . . . . . 0 C--O 1.248 0.984 0 O-C-N 124.065 0.853 . . . . 0.0 110.843 173.864 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.42 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 22.7 t . . . . . 0 N--CA 1.453 -0.316 0 N-CA-C 110.159 -0.312 . . . . 0.0 110.159 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 53.2 mtt180 -129.52 -176.29 3.85 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 121.033 0.444 . . . . 0.0 110.733 -179.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.425 ' HB2' HD12 ' A' ' 74' ' ' LEU . 16.1 m -124.11 138.77 54.39 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.58 -178.565 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.439 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 52.3 m-85 -122.24 133.05 54.71 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.584 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 8.0 ptp180 -100.5 157.62 16.51 Favored 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 119.998 -0.681 . . . . 0.0 110.261 175.551 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.433 HG12 ' CD2' ' A' ' 71' ' ' LEU . 22.2 mt -100.64 116.35 43.94 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.944 -179.784 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 1.4 m -92.22 -19.75 21.89 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.882 -177.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 164.79 -149.41 16.12 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.424 -179.28 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.459 ' HB3' HG21 ' A' ' 19' ' ' ILE . 72.5 m-85 -121.97 152.63 39.5 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.828 0.347 . . . . 0.0 110.821 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.737 ' O ' HG22 ' A' ' 19' ' ' ILE . 49.4 m -82.24 153.25 68.85 Favored Pre-proline 0 N--CA 1.448 -0.542 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.887 -179.53 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -62.38 -16.26 50.48 Favored 'Trans proline' 0 CA--C 1.532 0.395 0 C-N-CA 122.693 2.262 . . . . 0.0 113.218 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -83.92 -7.18 59.49 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -177.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.737 HG22 ' O ' ' A' ' 16' ' ' SER . 10.4 tt -92.88 147.7 5.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 C-N-CA 120.556 -0.458 . . . . 0.0 110.719 -179.409 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.3 t -84.98 158.1 20.6 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.635 -0.505 . . . . 0.0 109.635 178.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.493 ' O ' ' HB3' ' A' ' 24' ' ' ARG . 26.8 t-20 -63.5 -47.48 81.54 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.649 0.261 . . . . 0.0 111.373 -174.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.73 -38.33 95.48 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.433 -0.889 . . . . 0.0 112.208 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -64.53 -39.89 94.6 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 177.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.493 ' HB3' ' O ' ' A' ' 21' ' ' ASN . 15.9 ttm180 -56.2 -45.22 79.92 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.376 172.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -68.91 -31.57 70.58 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.224 -178.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.466 ' O ' ' HG3' ' A' ' 30' ' ' MET . 4.0 tmm_? -68.71 -39.68 80.32 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 175.509 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.452 HD22 HD12 ' A' ' 32' ' ' LEU . 40.2 mt -68.18 -40.5 82.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.332 0.587 . . . . 0.0 110.317 176.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -55.57 -48.02 75.47 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.079 174.255 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 47.8 m -60.07 -33.89 72.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.15 178.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.466 ' HG3' ' O ' ' A' ' 26' ' ' ARG . 90.1 mtp -70.47 -27.33 64.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.898 178.649 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.77 8.07 11.22 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.356 -178.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.472 HD13 HD11 ' A' ' 69' ' ' LEU . 76.4 mt -99.69 94.03 6.14 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.009 0.433 . . . . 0.0 110.09 -179.388 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.515 ' HB2' ' HD2' ' A' ' 34' ' ' PRO . 1.7 pt? -140.31 161.83 53.03 Favored Pre-proline 0 N--CA 1.447 -0.596 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.496 -178.588 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.515 ' HD2' ' HB2' ' A' ' 33' ' ' LEU . 18.7 Cg_endo -59.74 128.46 27.01 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.867 2.378 . . . . 0.0 111.77 175.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 111.62 4.05 26.76 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.128 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -113.82 172.83 6.75 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 120.982 0.42 . . . . 0.0 110.132 178.201 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.584 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -152.89 139.66 18.95 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.412 -178.05 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.668 HD13 HG21 ' A' ' 52' ' ' VAL . 50.5 mt -127.16 136.72 52.47 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.193 -178.113 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 16.3 ttm180 -99.67 131.06 45.9 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 174.028 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.597 HG21 HD11 ' A' ' 43' ' ' ILE . 9.0 p -72.55 135.08 28.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.342 0.591 . . . . 0.0 111.695 -172.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 75.4 t -106.54 -47.34 8.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.643 176.331 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.626 ' HB2' ' HB2' ' A' ' 51' ' ' GLN . 79.0 mtt180 -157.64 138.91 13.57 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -172.533 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.597 HD11 HG21 ' A' ' 40' ' ' VAL . 4.5 mp -130.0 119.87 48.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 163.39 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.718 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -67.62 138.19 93.41 Favored Pre-proline 0 C--N 1.322 -0.607 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.125 -176.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -58.88 -19.17 45.99 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 123.618 2.879 . . . . 0.0 112.924 -178.463 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -55.96 -39.62 72.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.723 0.773 . . . . 0.0 110.727 176.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 162.16 -74.52 0.19 Allowed Glycine 0 CA--C 1.494 -1.23 0 N-CA-C 110.509 -1.036 . . . . 0.0 110.509 -175.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.635 ' OD1' HG13 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -163.23 120.72 1.23 Allowed Pre-proline 0 N--CA 1.436 -1.132 0 N-CA-C 115.543 1.683 . . . . 0.0 115.543 176.897 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.718 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 31.3 Cg_endo -116.33 155.08 0.03 OUTLIER 'Trans proline' 0 N--CA 1.437 -1.798 1 C-N-CA 125.348 4.032 . . . . 0.0 108.439 123.614 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.94 HD13 HD22 ' A' ' 66' ' ' LEU . 96.0 mt -118.45 103.81 15.18 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.721 0 C-N-CA 119.209 -0.997 . . . . 0.0 110.938 -177.535 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.706 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 36.0 mt-30 -92.9 123.31 36.07 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.979 177.199 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.668 HG21 HD13 ' A' ' 38' ' ' LEU . 27.1 m -139.68 170.3 15.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.164 -177.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -116.9 135.48 53.69 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.1 m -110.29 -41.24 4.45 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.673 -172.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.7 ttm180 -176.72 -37.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.747 -173.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -120.93 -53.44 2.06 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.879 0.371 . . . . 0.0 110.638 -174.464 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.6 t -142.31 175.07 10.05 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 -174.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.497 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 13.9 m -88.53 134.05 33.98 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-O 121.318 0.58 . . . . 0.0 110.624 -178.725 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.706 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 3.1 mm? -112.02 173.72 6.22 Favored 'General case' 0 C--N 1.317 -0.848 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.178 179.486 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.595 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -142.19 144.4 33.39 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.088 -178.416 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -154.36 -175.34 5.35 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 -178.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.415 ' HA ' ' HD3' ' A' ' 62' ' ' ARG . 19.6 mmt180 -107.42 160.27 15.76 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 122.208 1.004 . . . . 0.0 112.792 -178.445 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -56.0 -41.44 74.87 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 113.008 -1.905 . . . . 0.0 112.094 -179.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.552 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 42.8 tttp -66.97 -43.11 83.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.714 0.292 . . . . 0.0 110.489 -176.152 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -59.71 -40.68 88.75 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.145 177.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.94 HD22 HD13 ' A' ' 50' ' ' ILE . 10.4 tp -70.48 -39.02 74.48 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.632 179.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.74 -26.84 66.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.456 -179.208 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.632 ' HB3' ' HB ' ' A' ' 19' ' ' ILE . 94.6 mt -77.51 -7.65 56.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.983 0.421 . . . . 0.0 110.564 177.564 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.472 HD11 HD13 ' A' ' 32' ' ' LEU . 68.5 mt -99.02 140.91 32.47 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.662 174.342 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 28.7 m -85.74 114.05 22.4 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 172.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.567 HD11 ' HG ' ' A' ' 66' ' ' LEU . 68.9 mt -120.3 139.12 53.2 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.626 -174.332 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.418 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 28.5 m -127.0 129.52 23.97 Favored Pre-proline 0 C--N 1.318 -0.799 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.496 170.054 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.439 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 3.3 Cg_exo -75.65 162.43 35.46 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 122.108 1.872 . . . . 0.0 111.736 -179.289 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.425 HD12 ' HB2' ' A' ' 9' ' ' SER . 60.7 mt -69.78 -34.62 74.01 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.204 172.55 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 37.1 t70 . . . . . 0 C--O 1.25 1.121 0 CA-C-O 118.611 -0.709 . . . . 0.0 109.834 177.906 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 48.0 t . . . . . 0 N--CA 1.452 -0.337 0 CA-C-O 120.641 0.258 . . . . 0.0 111.104 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.408 ' H ' HG12 ' A' ' 40' ' ' VAL . 42.2 mtp85 -115.45 152.85 32.17 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.12 0.486 . . . . 0.0 111.475 -175.469 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.472 ' HB2' HD11 ' A' ' 74' ' ' LEU . 7.8 m -117.12 143.87 45.32 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.062 177.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 93.9 m-85 -128.89 140.03 51.87 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.813 0.339 . . . . 0.0 110.863 -175.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.61 ' HD3' ' HB2' ' A' ' 37' ' ' ALA . 28.7 mmt180 -83.75 150.91 25.51 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.829 175.21 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.597 HG12 ' CD2' ' A' ' 71' ' ' LEU . 46.0 mt -103.06 113.07 38.76 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 169.425 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 6.7 p -90.32 -11.68 40.01 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.06 0.457 . . . . 0.0 111.092 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 161.2 -158.33 30.0 Favored Glycine 0 N--CA 1.442 -0.955 0 C-N-CA 120.293 -0.956 . . . . 0.0 112.175 177.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 48.2 m-85 -114.99 150.17 36.23 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 -179.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.419 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 53.0 m -72.22 137.89 81.56 Favored Pre-proline 0 C--N 1.316 -0.884 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.424 -179.416 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 62.9 Cg_exo -52.88 156.3 9.63 Favored 'Trans proline' 0 C--O 1.237 0.474 0 C-N-CA 122.941 2.427 . . . . 0.0 112.548 178.396 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 17' ' ' PRO . . . 75.01 12.9 3.39 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.289 -177.143 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 16.0 tt -83.94 146.71 6.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.192 176.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.9 t -74.44 140.31 44.56 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 178.497 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -62.06 -49.83 74.4 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.917 -177.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.45 -31.27 80.32 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.976 -0.631 . . . . 0.0 112.359 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.446 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 21.5 t80 -72.59 -37.46 68.14 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.433 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.8 ttm180 -59.14 -43.0 91.99 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.759 172.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -66.04 -39.18 89.94 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.386 177.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.434 HH11 ' HD3' ' A' ' 26' ' ' ARG . 5.1 tpt180 -63.44 -39.31 94.14 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.019 178.268 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 23' ' ' TYR . 95.5 mt -66.58 -45.01 80.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.805 177.411 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -55.89 -47.77 76.82 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.3 176.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 50.3 m -60.93 -35.31 76.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.135 179.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 71.9 mtm -78.96 -14.98 58.89 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.75 -178.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 114.28 6.21 20.41 Favored Glycine 0 N--CA 1.453 -0.209 0 C-N-CA 120.331 -0.938 . . . . 0.0 113.026 175.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.665 HD13 HD11 ' A' ' 69' ' ' LEU . 82.6 mt -99.87 87.04 3.41 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 178.634 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.416 ' HB2' ' HD2' ' A' ' 34' ' ' PRO . 1.8 pt? -129.99 157.64 76.33 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.757 -177.186 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.416 ' HD2' ' HB2' ' A' ' 33' ' ' LEU . 18.0 Cg_endo -61.06 123.75 13.51 Favored 'Trans proline' 0 C--O 1.235 0.341 0 C-N-CA 122.534 2.156 . . . . 0.0 111.577 177.05 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 111.9 -17.43 24.98 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 121.04 -0.6 . . . . 0.0 111.856 -176.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -91.84 111.44 22.97 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.068 0.461 . . . . 0.0 110.234 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.61 ' HB2' ' HD3' ' A' ' 11' ' ' ARG . . . -90.37 129.06 36.62 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.828 177.353 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.417 ' N ' HD22 ' A' ' 38' ' ' LEU . 2.8 mm? -104.31 143.54 32.84 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.561 178.367 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 39' ' ' ARG . 36.1 ttm180 -105.21 124.62 49.85 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.339 176.482 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.408 HG12 ' H ' ' A' ' 8' ' ' ARG . 5.8 p -66.87 125.88 25.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.18 0.515 . . . . 0.0 110.377 -178.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 21.2 t -104.97 -39.46 5.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.543 -178.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 19.6 ttm180 -158.1 121.71 4.01 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 121.095 -0.242 . . . . 0.0 110.887 179.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.489 ' HA ' HG23 ' A' ' 50' ' ' ILE . 4.2 mp -97.42 130.37 46.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 178.514 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.461 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -75.58 134.69 72.5 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 174.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 24.7 Cg_exo -64.16 -4.34 7.58 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 123.113 2.542 . . . . 0.0 113.425 -174.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 7.0 mp -93.36 -20.83 19.97 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.663 0.268 . . . . 0.0 111.113 -179.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.62 -16.93 60.25 Favored Glycine 0 N--CA 1.453 -0.231 0 N-CA-C 110.774 -0.93 . . . . 0.0 110.774 -172.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.755 ' HB3' ' HD2' ' A' ' 49' ' ' PRO . 0.4 OUTLIER -69.43 170.05 10.39 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 114.72 -0.74 . . . . 0.0 109.594 171.726 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.827 ' HD3' ' HD3' ' A' ' 62' ' ' ARG . 5.6 Cg_exo -32.37 150.0 0.02 OUTLIER 'Trans proline' 0 C--N 1.361 1.209 0 C-N-CA 124.849 3.699 . . . . 0.0 116.718 -155.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.489 HG23 ' HA ' ' A' ' 43' ' ' ILE . 69.1 mt -124.07 134.22 67.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-N 113.684 -1.598 . . . . 0.0 109.634 -173.642 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.448 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 2.3 mp0 -78.76 120.69 23.76 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 177.686 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.457 ' O ' ' HA ' ' A' ' 58' ' ' SER . 27.3 m -128.4 160.01 39.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.666 -178.009 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -112.37 130.82 55.83 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.715 -173.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.5 t -104.09 -34.44 8.41 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.979 176.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 34.1 mtp180 -153.34 -89.35 0.05 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.526 177.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -112.89 0.79 15.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.484 -178.084 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.5 t -133.0 154.7 50.27 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.878 -177.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.457 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 7.2 m -104.92 139.21 39.97 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.663 -178.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.448 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 7.4 mp -118.0 173.23 6.89 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.942 178.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -142.52 141.78 32.13 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.667 0.27 . . . . 0.0 110.766 -179.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.476 ' O ' ' HA ' ' A' ' 49' ' ' PRO . 3.3 pp -143.97 150.99 39.16 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 178.638 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.827 ' HD3' ' HD3' ' A' ' 49' ' ' PRO . 32.1 mmt180 -73.77 174.16 8.82 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 121.382 0.611 . . . . 0.0 111.173 -176.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.411 ' HD2' HH11 ' A' ' 63' ' ' ARG . 16.9 ptt180 -70.35 -33.7 71.77 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.895 179.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.445 ' HD2' ' C ' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -57.41 -47.4 81.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.074 174.14 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -68.28 -37.7 80.93 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.955 -177.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 38.8 tp -59.31 -38.94 81.54 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.842 177.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.93 -25.63 63.75 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.153 -178.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 82.0 mt -83.91 -8.6 59.14 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.23 -177.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.665 HD11 HD13 ' A' ' 32' ' ' LEU . 96.9 mt -103.86 132.7 49.86 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 110.251 -0.277 . . . . 0.0 110.251 178.036 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.0 m -89.43 114.18 25.62 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 175.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.597 ' CD2' HG12 ' A' ' 12' ' ' ILE . 73.6 mt -118.71 132.21 56.15 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.001 -173.391 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 27.2 m -122.06 132.77 24.19 Favored Pre-proline 0 C--N 1.318 -0.804 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.625 173.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -69.45 163.41 38.11 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 121.84 1.693 . . . . 0.0 112.426 -176.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.472 HD11 ' HB2' ' A' ' 9' ' ' SER . 85.9 mt -67.04 -14.97 63.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.732 173.116 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.6 t0 . . . . . 0 C--O 1.252 1.204 0 O-C-N 124.165 0.916 . . . . 0.0 110.318 -178.231 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.9 t . . . . . 0 N--CA 1.45 -0.468 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 -155.79 144.77 20.58 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 176.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.533 ' HB2' HD11 ' A' ' 74' ' ' LEU . 15.1 m -90.94 140.7 29.58 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 -179.598 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -124.27 142.22 51.43 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.843 0.354 . . . . 0.0 110.7 -175.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.597 ' HG3' HD23 ' A' ' 74' ' ' LEU . 90.6 mtt-85 -99.05 157.25 16.47 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.717 175.422 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 49.7 mt -94.07 112.99 27.85 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.739 179.006 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.96 -33.35 70.38 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.434 0.635 . . . . 0.0 110.156 178.154 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.555 ' HA2' ' HB3' ' A' ' 34' ' ' PRO . . . 153.94 -147.36 16.59 Favored Glycine 0 N--CA 1.444 -0.807 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.329 -179.655 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -113.61 160.56 18.43 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 -179.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.441 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 34.0 t -62.8 133.01 94.96 Favored Pre-proline 0 C--N 1.321 -0.665 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 172.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 31.7 Cg_exo -60.1 -16.53 40.2 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.895 2.396 . . . . 0.0 112.727 -178.683 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -103.6 24.33 11.3 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.081 -178.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 18.4 tt -71.2 155.01 7.67 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 175.564 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.1 p -124.24 127.15 47.26 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -172.113 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.417 ' HB3' ' H ' ' A' ' 22' ' ' GLY . 16.7 m120 64.94 -156.32 0.29 Allowed 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.222 -0.899 . . . . 0.0 112.478 168.615 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.417 ' H ' ' HB3' ' A' ' 21' ' ' ASN . . . -75.14 15.09 4.39 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 115.337 -0.847 . . . . 0.0 113.356 -175.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.406 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 29.1 t80 -61.95 -36.09 80.38 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 174.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 4.4 tmm_? -64.62 -39.77 94.29 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.373 175.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -68.58 -35.31 77.2 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.246 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -64.4 -41.44 96.64 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.691 176.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.825 HD13 HD21 ' A' ' 69' ' ' LEU . 83.7 mt -67.17 -43.66 81.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.186 177.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -59.5 -44.58 93.05 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.502 178.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.3 m -64.24 -33.77 76.58 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.886 179.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 70.4 mtm -78.12 -16.47 57.93 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.327 -178.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 112.78 11.87 13.7 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.427 -0.892 . . . . 0.0 113.013 174.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 94.4 mt -100.63 95.9 7.0 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.794 0.331 . . . . 0.0 110.321 179.447 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -132.52 152.81 80.66 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.686 -179.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.555 ' HB3' ' HA2' ' A' ' 14' ' ' GLY . 24.0 Cg_endo -62.4 139.14 75.22 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.855 2.37 . . . . 0.0 112.132 179.11 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 107.36 -26.33 18.84 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.298 178.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.07 -172.47 4.15 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 121.141 0.496 . . . . 0.0 110.212 -178.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.563 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -145.28 144.06 30.55 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.066 -176.606 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.419 HD13 HG21 ' A' ' 52' ' ' VAL . 84.1 mt -118.47 137.82 52.92 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.687 178.013 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 40.2 ttt85 -101.71 117.62 35.25 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.546 ' HA ' HG12 ' A' ' 52' ' ' VAL . 14.5 p -62.48 127.1 21.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.66 0.743 . . . . 0.0 111.707 -176.253 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 91.6 t -90.4 -61.26 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.969 170.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 50.1 mtp180 -167.13 155.43 9.69 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 123.72 0.638 . . . . 0.0 111.597 -177.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.485 HG23 ' HD2' ' A' ' 49' ' ' PRO . 3.3 mp -117.15 116.7 52.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 163.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -54.13 135.02 59.29 Favored Pre-proline 0 C--N 1.326 -0.416 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -67.86 -1.58 7.12 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.812 2.341 . . . . 0.0 112.141 179.133 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.42 HD13 ' HA ' ' A' ' 46' ' ' LEU . 3.9 mm? -63.8 -28.8 70.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.577 174.268 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 157.46 -76.59 0.2 Allowed Glycine 0 N--CA 1.438 -1.181 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.939 -176.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -167.78 120.01 0.72 Allowed Pre-proline 0 N--CA 1.448 -0.543 0 N-CA-C 113.882 1.067 . . . . 0.0 113.882 176.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.485 ' HD2' HG23 ' A' ' 43' ' ' ILE . 81.1 Cg_endo -118.67 -168.72 0.02 OUTLIER 'Trans proline' 0 N--CA 1.433 -2.055 1 C-N-CA 126.372 4.715 . . . . 0.0 108.243 140.318 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.741 HD12 HD11 ' A' ' 61' ' ' LEU . 62.6 mt -140.67 100.62 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 168.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.439 ' OE1' ' HB2' ' A' ' 60' ' ' ALA . 5.3 tp60 -86.93 116.52 25.04 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 178.478 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.546 HG12 ' HA ' ' A' ' 40' ' ' VAL . 11.5 m -136.79 175.97 8.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.528 0.204 . . . . 0.0 110.56 -177.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.44 ' HG2' ' H ' ' A' ' 55' ' ' ARG . 40.8 tt0 -147.17 138.88 24.19 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 176.065 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -86.16 27.23 0.93 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.093 0.473 . . . . 0.0 109.912 176.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.44 ' H ' ' HG2' ' A' ' 53' ' ' GLU . 43.3 ttm105 67.1 16.01 10.19 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 121.904 0.859 . . . . 0.0 109.923 -175.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -139.42 -70.55 0.4 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.382 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 17.0 m -114.61 141.65 47.5 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.046 177.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 23.1 p -85.32 146.98 26.76 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.954 0.407 . . . . 0.0 110.491 176.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 15.9 mt -141.19 167.35 22.38 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.639 -179.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.499 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -137.93 154.77 49.38 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 114.678 -1.146 . . . . 0.0 109.873 -179.385 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.741 HD11 HD12 ' A' ' 50' ' ' ILE . 1.3 pp -157.31 168.3 27.78 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 -179.785 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.648 ' HD3' ' OD2' ' A' ' 65' ' ' ASP . 0.1 OUTLIER -107.63 172.49 6.8 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.042 0.449 . . . . 0.0 110.329 -176.899 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.504 ' HG3' ' N ' ' A' ' 64' ' ' LYS . 0.2 OUTLIER -59.97 -34.03 72.74 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.549 174.258 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.504 ' N ' ' HG3' ' A' ' 63' ' ' ARG . 1.5 tmtp? -62.5 -40.91 98.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.969 -1.014 . . . . 0.0 110.297 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.648 ' OD2' ' HD3' ' A' ' 62' ' ' ARG . 26.1 m-20 -72.94 -37.86 66.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.797 179.168 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 53.0 tp -61.27 -31.63 71.45 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.481 177.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.11 -10.9 60.41 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.302 178.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 95.9 mt -110.59 -5.29 15.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.962 0.411 . . . . 0.0 110.815 179.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.825 HD21 HD13 ' A' ' 27' ' ' LEU . 98.7 mt -123.53 125.29 44.62 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.623 -177.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 6.7 m -91.53 114.25 26.73 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.009 0.433 . . . . 0.0 110.065 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 8.9 mp -125.65 143.61 50.96 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.466 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 15.6 m -137.23 159.15 70.82 Favored Pre-proline 0 C--N 1.32 -0.697 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.643 178.143 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -61.29 167.64 9.09 Favored 'Trans proline' 0 C--O 1.234 0.284 0 C-N-CA 122.206 1.938 . . . . 0.0 112.068 177.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.597 HD23 ' HG3' ' A' ' 11' ' ' ARG . 86.3 mt -54.42 -56.25 20.57 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.985 0.421 . . . . 0.0 110.383 176.441 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.6 t0 . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.259 -0.876 . . . . 0.0 109.287 177.858 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 38.5 t . . . . . 0 N--CA 1.449 -0.493 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.411 ' O ' HG12 ' A' ' 40' ' ' VAL . 87.9 mtt180 -133.68 179.67 6.09 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 121.384 0.612 . . . . 0.0 110.884 -179.08 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 37.3 m -124.59 129.64 50.95 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.085 176.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -113.99 149.18 35.72 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.917 0.389 . . . . 0.0 110.87 -174.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 78.7 mtp180 -105.46 153.24 21.98 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 174.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.662 HD12 ' HB3' ' A' ' 36' ' ' ALA . 35.2 mt -97.2 105.58 17.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 177.354 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.66 -31.45 71.46 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.4 0.619 . . . . 0.0 110.188 179.059 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 160.09 -153.49 24.46 Favored Glycine 0 N--CA 1.443 -0.89 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.311 -178.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 66.2 m-85 -99.38 162.39 13.07 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 179.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.7 t -69.63 132.67 89.05 Favored Pre-proline 0 C--N 1.317 -0.845 0 N-CA-C 109.103 -0.702 . . . . 0.0 109.103 172.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -63.33 -7.07 11.29 Favored 'Trans proline' 0 C--O 1.233 0.255 0 C-N-CA 122.595 2.197 . . . . 0.0 112.67 -178.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.37 1.71 56.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.287 178.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 14.7 tt -75.12 146.75 9.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 179.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.7 t -160.37 -178.95 7.28 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 121.166 -0.214 . . . . 0.0 110.451 -177.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.4 t30 70.78 7.4 6.2 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 123.731 0.812 . . . . 0.0 111.767 175.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.7 14.13 61.79 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.542 -0.837 . . . . 0.0 113.051 177.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -65.28 -24.16 67.23 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.002 0.429 . . . . 0.0 110.085 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.411 HH11 ' HD3' ' A' ' 24' ' ' ARG . 25.8 ttt180 -53.1 -48.66 67.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.578 173.566 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -64.98 -28.17 69.33 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.353 -179.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 26.5 tpt180 -74.33 -40.96 61.84 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.852 176.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.68 HD22 HD12 ' A' ' 32' ' ' LEU . 46.1 mt -66.91 -42.1 86.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.755 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -59.72 -43.15 94.29 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.923 177.081 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 70.1 m -63.15 -30.69 71.79 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.323 177.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 89.3 mtp -80.23 -16.18 55.34 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.218 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 108.98 10.82 23.76 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.479 -0.867 . . . . 0.0 112.647 176.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.903 HD13 HD11 ' A' ' 69' ' ' LEU . 84.8 mt -101.42 100.11 10.54 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.961 0.41 . . . . 0.0 109.925 179.374 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.408 ' H ' HD23 ' A' ' 33' ' ' LEU . 1.9 pt? -131.8 156.12 80.52 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.817 -177.463 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -64.69 125.44 14.88 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.719 2.28 . . . . 0.0 111.473 176.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 109.55 -1.07 30.73 Favored Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.652 -0.785 . . . . 0.0 112.838 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.662 ' HB3' HD12 ' A' ' 12' ' ' ILE . . . -88.4 -172.75 3.9 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 120.989 0.423 . . . . 0.0 110.046 178.807 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -158.13 146.88 19.09 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.455 -177.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.437 HD13 HG21 ' A' ' 52' ' ' VAL . 82.5 mt -137.74 139.85 40.35 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.925 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 52.5 ttm-85 -101.72 124.85 48.05 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 175.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.603 ' HA ' HG12 ' A' ' 52' ' ' VAL . 9.3 p -75.88 122.69 30.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.522 0.677 . . . . 0.0 110.622 -177.239 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.599 HG12 ' HG3' ' A' ' 42' ' ' ARG . 48.9 t -93.73 -52.9 9.13 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.36 178.279 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.599 ' HG3' HG12 ' A' ' 41' ' ' VAL . 96.5 mtt180 -152.74 140.39 19.86 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -174.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.453 HD11 HG21 ' A' ' 40' ' ' VAL . 4.5 mp -116.27 144.22 24.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 164.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.603 ' H ' ' CD ' ' A' ' 49' ' ' PRO . . . -81.94 138.36 46.42 Favored Pre-proline 0 C--N 1.318 -0.785 0 CA-C-N 117.788 0.267 . . . . 0.0 110.923 178.645 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -66.14 -5.31 12.07 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 123.24 2.626 . . . . 0.0 112.56 179.489 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -65.53 -35.89 82.2 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.206 174.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 158.65 -77.49 0.19 Allowed Glycine 0 N--CA 1.438 -1.226 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.037 -176.197 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -153.62 120.03 2.88 Favored Pre-proline 0 N--CA 1.445 -0.724 0 N-CA-C 114.501 1.297 . . . . 0.0 114.501 179.302 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.603 ' CD ' ' H ' ' A' ' 44' ' ' ALA . 94.6 Cg_endo -119.51 -173.51 0.02 OUTLIER 'Trans proline' 0 N--CA 1.436 -1.854 1 C-N-CA 126.482 4.788 . . . . 0.0 107.693 131.301 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.732 HG22 HG13 ' A' ' 52' ' ' VAL . 57.1 mt -142.1 100.85 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.425 0 C-N-CA 119.749 -0.78 . . . . 0.0 109.942 170.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.585 HE22 ' HB3' ' A' ' 58' ' ' SER . 0.0 OUTLIER -87.57 112.57 22.41 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 178.437 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.732 HG13 HG22 ' A' ' 50' ' ' ILE . 24.2 m -129.41 -177.12 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.831 0.348 . . . . 0.0 110.59 -177.058 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -133.74 132.1 40.18 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 174.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.4 m -76.79 -30.98 56.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.082 0.467 . . . . 0.0 110.931 -176.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.408 ' HD3' HH11 ' A' ' 55' ' ' ARG . 9.3 ptp180 173.72 -26.26 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.642 -178.406 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -155.25 -36.73 0.09 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.166 -179.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.7 t -96.88 141.73 29.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.416 -179.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.585 ' HB3' HE22 ' A' ' 51' ' ' GLN . 45.4 m -80.95 146.59 30.67 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.618 178.445 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.8 tp -138.62 159.92 40.9 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.296 -179.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.572 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -138.94 156.84 46.93 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.927 -0.398 . . . . 0.0 109.927 177.74 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.656 HD11 HD12 ' A' ' 50' ' ' ILE . 3.7 pp -161.94 168.8 22.28 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -178.119 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.648 ' HD3' ' OD2' ' A' ' 65' ' ' ASP . 0.0 OUTLIER -109.43 169.04 8.95 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.448 0.642 . . . . 0.0 111.293 -177.603 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.572 ' HD2' ' N ' ' A' ' 64' ' ' LYS . 2.0 ppt_? -58.35 -33.25 69.35 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.69 -1.141 . . . . 0.0 111.796 176.223 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.572 ' N ' ' HD2' ' A' ' 63' ' ' ARG . 88.6 tttt -63.96 -44.61 92.27 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.489 176.406 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.648 ' OD2' ' HD3' ' A' ' 62' ' ' ARG . 23.3 m-20 -65.94 -36.8 84.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.287 0.565 . . . . 0.0 109.596 177.757 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.3 tp -59.25 -35.68 74.12 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.621 175.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.87 -10.48 58.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.622 -178.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 78.5 mt -94.84 -13.85 25.15 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.958 0.409 . . . . 0.0 110.444 178.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.903 HD11 HD13 ' A' ' 32' ' ' LEU . 96.7 mt -115.03 150.08 36.44 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.071 0.462 . . . . 0.0 110.865 -177.615 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 22.6 m -108.51 118.89 37.95 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.368 -0.605 . . . . 0.0 109.368 170.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 77.9 mt -120.02 138.41 53.53 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.99 -174.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.427 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 19.7 m -130.73 134.42 25.99 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.659 174.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 72' ' ' VAL . 27.7 Cg_exo -62.07 164.59 16.55 Favored 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 122.283 1.989 . . . . 0.0 112.103 179.499 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 96.0 mt -53.25 -42.1 66.13 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.538 175.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 33.9 t70 . . . . . 0 C--O 1.247 0.962 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.77 177.607 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 29.7 t . . . . . 0 N--CA 1.453 -0.302 0 CA-C-O 120.45 0.167 . . . . 0.0 111.176 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.413 ' HD2' ' HA ' ' A' ' 8' ' ' ARG . 0.5 OUTLIER -93.66 164.88 12.98 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.99 0.424 . . . . 0.0 110.487 -177.057 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.462 ' OG ' ' HG3' ' A' ' 39' ' ' ARG . 16.6 m -132.51 139.18 47.81 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.886 178.386 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.402 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 59.3 m-85 -120.4 133.44 55.43 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.116 -177.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.66 HH11 ' HB2' ' A' ' 37' ' ' ALA . 21.8 mmm180 -89.21 148.52 23.57 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 178.33 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.54 HG12 ' CD2' ' A' ' 71' ' ' LEU . 47.7 mt -102.42 113.06 37.87 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 175.364 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 4.5 p -81.21 -23.37 38.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.859 0.361 . . . . 0.0 110.904 179.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 161.75 -145.89 11.43 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 120.457 -0.878 . . . . 0.0 112.102 -178.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -117.99 154.55 31.78 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.161 0.505 . . . . 0.0 110.889 -175.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.435 ' O ' HG22 ' A' ' 19' ' ' ILE . 43.3 t -73.64 139.99 78.05 Favored Pre-proline 0 C--N 1.318 -0.782 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.319 174.148 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 31.3 Cg_exo -60.5 -8.73 9.43 Favored 'Trans proline' 0 N--CA 1.475 0.398 0 C-N-CA 123.152 2.568 . . . . 0.0 113.341 -178.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.63 -6.36 58.93 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.515 179.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.435 HG22 ' O ' ' A' ' 16' ' ' SER . 16.5 tt -79.23 139.47 18.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-O 120.909 0.385 . . . . 0.0 110.006 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.8 p -153.41 170.97 19.4 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -176.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 67.62 38.01 3.17 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.578 172.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.94 21.04 75.12 Favored Glycine 0 N--CA 1.454 -0.136 0 C-N-CA 121.027 -0.606 . . . . 0.0 113.594 174.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.416 ' HB3' ' CG1' ' A' ' 19' ' ' ILE . 7.3 t80 -66.83 -22.83 65.99 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.829 0.347 . . . . 0.0 110.446 -177.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 32.1 mtp180 -64.52 -40.89 96.45 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.663 175.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -69.12 -35.52 76.5 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 120.989 0.423 . . . . 0.0 110.141 179.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -66.06 -42.18 89.78 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.872 177.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.566 HD22 HD12 ' A' ' 32' ' ' LEU . 61.2 mt -70.97 -34.95 71.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.537 -179.785 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -58.46 -44.32 89.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.35 176.405 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 49.3 m -61.44 -35.34 77.31 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.806 178.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 91.9 mtp -75.79 -36.34 59.78 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.51 -178.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.04 14.97 5.34 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.202 -178.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.566 HD12 HD22 ' A' ' 27' ' ' LEU . 94.5 mt -104.46 91.98 4.12 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.911 0.386 . . . . 0.0 110.25 179.375 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.491 ' HB2' ' HD2' ' A' ' 34' ' ' PRO . 1.7 pt? -137.83 160.54 64.35 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.392 -179.224 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.491 ' HD2' ' HB2' ' A' ' 33' ' ' LEU . 13.8 Cg_endo -57.44 129.99 36.78 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.797 2.331 . . . . 0.0 111.659 176.716 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 110.75 -17.27 27.93 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.227 -177.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.66 100.55 12.9 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.913 0.387 . . . . 0.0 110.714 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.66 ' HB2' HH11 ' A' ' 11' ' ' ARG . . . -75.8 134.55 40.37 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.906 177.421 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 34.7 mt -110.21 135.91 50.25 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.567 -178.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.565 ' HB2' ' HB3' ' A' ' 53' ' ' GLU . 0.3 OUTLIER -94.55 147.44 23.27 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 172.928 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 11.8 p -85.15 124.11 39.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-O 120.831 0.348 . . . . 0.0 111.036 -176.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 96.0 t -102.63 -50.19 9.93 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 C-N-CA 120.776 -0.37 . . . . 0.0 110.678 173.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.401 ' HB2' ' HE ' ' A' ' 42' ' ' ARG . 2.1 ttm180 -177.12 158.04 1.46 Allowed 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -175.801 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.403 HG23 ' CB ' ' A' ' 48' ' ' ASP . 46.7 mm -129.85 141.7 45.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 170.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.504 ' HB2' ' CD ' ' A' ' 49' ' ' PRO . . . -65.63 152.54 92.51 Favored Pre-proline 0 N--CA 1.469 0.522 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -179.49 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -69.07 -32.1 22.17 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 122.728 2.285 . . . . 0.0 112.616 175.66 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.413 HD13 ' HA ' ' A' ' 46' ' ' LEU . 4.0 mm? -65.51 -88.58 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.809 0.814 . . . . 0.0 110.45 177.095 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.542 ' O ' ' HB3' ' A' ' 48' ' ' ASP . . . -115.08 -79.27 0.82 Allowed Glycine 0 N--CA 1.432 -1.602 0 N-CA-C 109.119 -1.592 . . . . 0.0 109.119 169.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.559 ' OD1' ' HD3' ' A' ' 63' ' ' ARG . 6.0 p-10 166.98 133.3 0.04 OUTLIER Pre-proline 0 N--CA 1.451 -0.423 0 N-CA-C 113.925 1.083 . . . . 0.0 113.925 -178.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.504 ' CD ' ' HB2' ' A' ' 44' ' ' ALA . 7.5 Cg_endo -96.65 152.09 1.17 Allowed 'Trans proline' 0 N--CA 1.432 -2.134 0 N-CA-C 106.828 -2.028 . . . . 0.0 106.828 132.501 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.729 HD13 HD22 ' A' ' 66' ' ' LEU . 62.1 mt -106.23 100.69 11.15 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.695 0 C-N-CA 119.566 -0.853 . . . . 0.0 110.092 -173.802 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -82.4 117.0 22.13 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.711 178.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.521 HG13 HG22 ' A' ' 50' ' ' ILE . 31.1 m -137.4 172.51 14.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.04 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.565 ' HB3' ' HB2' ' A' ' 39' ' ' ARG . 42.9 tt0 -123.18 123.02 39.85 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 176.121 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.7 p -85.14 -30.79 23.7 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.795 -173.091 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 46.8 ttp180 -174.17 -46.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.861 0.362 . . . . 0.0 110.862 179.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 21.9 mt-30 -134.37 -27.13 1.39 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.747 -175.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.8 t -125.8 160.64 29.3 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.852 0.358 . . . . 0.0 111.016 -176.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.3 m -86.08 142.93 28.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.276 177.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 10.3 tt -137.96 145.24 41.75 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.086 -178.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.539 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -121.74 143.51 49.33 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.414 179.054 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.2 pp -150.87 176.55 10.98 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 -178.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -96.42 156.15 16.46 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.477 0.655 . . . . 0.0 111.704 -177.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.559 ' HD3' ' OD1' ' A' ' 48' ' ' ASP . 28.0 ptt-85 -65.11 -33.61 76.43 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.664 179.266 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -55.43 -43.95 75.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.28 176.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -68.47 -39.46 81.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.555 177.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.926 HD11 HD11 ' A' ' 71' ' ' LEU . 18.6 tp -65.45 -29.04 69.67 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.987 -179.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.65 -15.91 63.67 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.84 178.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.43 ' HA ' ' HB3' ' A' ' 16' ' ' SER . 93.5 mt -96.92 -3.72 41.31 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.697 178.371 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.2 mt -110.3 130.0 55.63 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.133 178.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 31.4 m -92.1 116.41 28.91 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.348 0.594 . . . . 0.0 110.416 177.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.926 HD11 HD11 ' A' ' 66' ' ' LEU . 77.2 mt -108.57 144.77 35.82 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.102 -176.449 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.419 HG23 ' HB2' ' A' ' 11' ' ' ARG . 15.9 m -132.33 119.23 16.37 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.505 170.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 23.5 Cg_exo -63.5 163.15 24.9 Favored 'Trans proline' 0 C--O 1.237 0.473 0 C-N-CA 122.209 1.939 . . . . 0.0 112.293 -178.165 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.416 ' CD1' ' HB2' ' A' ' 9' ' ' SER . 61.0 mt -65.68 -30.4 71.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.335 173.325 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 . . . . . 0 C--O 1.251 1.132 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.779 178.443 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.5 m . . . . . 0 N--CA 1.44 -0.964 0 CA-C-O 121.002 0.43 . . . . 0.0 110.446 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.6 mtt180 -155.18 157.13 36.91 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.499 -178.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.532 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 39.1 m -122.57 130.27 52.83 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.837 -1.074 . . . . 0.0 108.513 170.118 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -110.5 142.03 42.83 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.373 -177.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 12.9 ptt180 -108.05 148.67 29.45 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.303 0.573 . . . . 0.0 110.493 177.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.568 HG12 ' CD2' ' A' ' 71' ' ' LEU . 22.4 mt -90.2 113.34 26.12 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.618 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 10.5 t -91.13 -11.04 39.72 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.744 -0.382 . . . . 0.0 111.143 -178.062 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.666 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 161.36 -168.47 36.6 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.343 -0.932 . . . . 0.0 112.211 177.295 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -98.54 157.06 16.47 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 177.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.4 t -59.24 140.16 87.9 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.642 175.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -65.17 -14.57 45.85 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.271 1.981 . . . . 0.0 111.596 175.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -102.69 12.66 36.0 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.14 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.506 HG13 HD22 ' A' ' 68' ' ' LEU . 12.3 tt -76.27 146.24 9.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.126 0.489 . . . . 0.0 111.006 -177.556 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.571 ' HB2' ' HD2' ' A' ' 23' ' ' TYR . 20.4 m -84.03 145.61 28.4 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.861 175.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -57.25 -43.08 82.66 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.021 0.378 . . . . 0.0 112.021 -175.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -67.51 -35.83 87.4 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.24 -179.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.571 ' HD2' ' HB2' ' A' ' 20' ' ' SER . 19.2 m-85 -67.49 -35.3 78.88 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 122.847 -0.208 . . . . 0.0 110.776 177.688 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 74.2 ttt-85 -62.55 -40.25 96.24 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 174.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -66.59 -40.67 88.99 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.704 177.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 52.9 ttt180 -61.29 -45.46 94.4 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.345 176.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 23' ' ' TYR . 66.9 mt -65.95 -42.84 89.48 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.604 -178.139 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -60.83 -43.32 98.42 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.949 178.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 59.2 m -66.78 -29.59 69.57 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.381 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 84.2 mtp -77.91 -18.11 56.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.037 177.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 103.38 15.01 24.42 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.374 178.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.565 HD13 HD11 ' A' ' 69' ' ' LEU . 92.3 mt -100.93 97.94 8.47 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.008 0.432 . . . . 0.0 110.117 -179.52 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.401 HD23 ' H ' ' A' ' 33' ' ' LEU . 1.9 pt? -132.9 159.2 73.56 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.133 -177.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.666 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 37.1 Cg_exo -60.47 128.58 26.48 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.653 2.236 . . . . 0.0 111.455 176.361 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 115.37 -12.73 18.92 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 120.668 -0.777 . . . . 0.0 111.891 -176.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.5 ' HB3' HD12 ' A' ' 12' ' ' ILE . . . -89.41 176.47 6.9 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-O 121.329 0.585 . . . . 0.0 110.09 179.156 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -147.19 150.65 35.32 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.134 -177.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 55.3 mt -127.53 131.34 50.07 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.66 177.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -107.67 127.69 53.89 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.704 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 14.7 p -62.17 124.72 17.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.174 0.511 . . . . 0.0 111.592 -176.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 85.1 t -97.26 -52.92 8.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.696 173.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 38.6 mtp-105 -151.54 157.01 41.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.137 179.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.478 HG12 HG23 ' A' ' 50' ' ' ILE . 64.9 mt -127.65 131.87 69.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 176.252 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.459 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -65.13 141.41 98.28 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.384 178.565 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 32.0 Cg_exo -59.24 -16.0 31.9 Favored 'Trans proline' 0 N--CA 1.476 0.48 0 C-N-CA 123.259 2.639 . . . . 0.0 113.65 -174.588 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.428 ' N ' HD22 ' A' ' 46' ' ' LEU . 2.2 mm? -89.12 -16.98 30.16 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.702 0.287 . . . . 0.0 111.202 -177.563 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.72 -16.86 60.39 Favored Glycine 0 N--CA 1.454 -0.125 0 N-CA-C 111.016 -0.833 . . . . 0.0 111.016 -174.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.905 ' HB3' ' HD2' ' A' ' 49' ' ' PRO . 1.5 m-20 -65.62 170.6 4.56 Favored Pre-proline 0 C--N 1.326 -0.448 0 C-N-CA 123.601 0.761 . . . . 0.0 110.616 173.346 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.905 ' HD2' ' HB3' ' A' ' 48' ' ' ASP . 23.3 Cg_exo -19.77 151.38 0.0 OUTLIER 'Trans proline' 0 C--N 1.366 1.459 1 C-N-CA 126.675 4.917 . . . . 0.0 117.434 -163.693 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.497 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 62.3 mt -123.6 138.8 52.18 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 CA-C-N 113.862 -1.517 . . . . 0.0 110.604 -166.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 27.8 mp0 -86.04 119.35 26.25 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 175.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 28.3 m -130.83 159.11 43.11 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.824 -176.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -116.41 141.83 47.66 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 -178.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.43 ' O ' ' HB2' ' A' ' 55' ' ' ARG . 35.4 p -97.69 -45.15 6.48 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.356 0.598 . . . . 0.0 109.879 179.438 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.43 ' HB2' ' O ' ' A' ' 54' ' ' THR . 0.0 OUTLIER 167.66 -46.46 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 114.508 -1.224 . . . . 0.0 107.971 -173.238 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.53 -54.91 2.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.0 -175.706 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.9 t -126.86 144.34 51.01 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.041 -172.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 9.9 m -91.62 139.27 30.86 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.643 -178.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.7 mp -121.14 168.91 11.06 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.789 -178.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.497 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -142.18 124.9 15.93 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.321 175.019 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.576 ' HB2' ' HB2' ' A' ' 65' ' ' ASP . 3.5 pp -126.56 146.66 50.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.642 -173.119 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.715 ' HG3' ' HG3' ' A' ' 49' ' ' PRO . 1.0 OUTLIER -86.97 178.04 7.06 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.555 -175.172 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 44.5 mtt180 -54.73 -39.35 68.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.764 174.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.487 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 84.2 tttt -61.76 -50.68 71.39 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.86 179.053 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.576 ' HB2' ' HB2' ' A' ' 61' ' ' LEU . 24.8 m-20 -64.67 -40.05 94.73 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.928 -178.23 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 49.7 tp -59.96 -43.43 95.05 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.07 177.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.9 -13.93 62.2 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -177.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.506 HD22 HG13 ' A' ' 19' ' ' ILE . 97.3 mt -80.11 -28.05 39.09 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.723 0.297 . . . . 0.0 110.607 178.14 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.565 HD11 HD13 ' A' ' 32' ' ' LEU . 96.0 mt -104.71 140.86 37.45 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.414 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.9 m -92.11 113.12 25.3 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 170.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.568 ' CD2' HG12 ' A' ' 12' ' ' ILE . 89.6 mt -113.28 133.4 55.12 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.608 -174.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 17.1 m -129.71 142.02 43.86 Favored Pre-proline 0 C--N 1.316 -0.855 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.561 174.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -67.87 163.24 36.28 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 121.764 1.643 . . . . 0.0 111.416 179.38 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' A' ' 9' ' ' SER . 75.4 mt -59.02 -63.38 1.32 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.741 175.542 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.06 -0.972 . . . . 0.0 110.007 178.965 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.8 t . . . . . 0 N--CA 1.448 -0.543 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 54.4 mtt180 -147.12 175.22 10.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.013 0.435 . . . . 0.0 110.611 176.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.1 t -114.17 135.67 53.79 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 174.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -119.92 146.58 45.66 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 -174.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.471 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 2.5 ptp180 -104.09 147.17 27.72 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.133 0.492 . . . . 0.0 110.424 178.543 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.564 HG12 ' CD2' ' A' ' 71' ' ' LEU . 46.9 mt -86.28 113.39 24.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.797 178.055 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 3.5 m -68.4 -35.3 77.45 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.266 0.555 . . . . 0.0 110.146 178.26 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.424 ' HA2' ' HB3' ' A' ' 34' ' ' PRO . . . 159.15 -153.25 24.34 Favored Glycine 0 N--CA 1.44 -1.087 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.112 -178.394 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -100.5 151.62 21.35 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 120.908 0.385 . . . . 0.0 110.098 179.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.427 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 27.9 t -72.14 140.06 82.6 Favored Pre-proline 0 C--N 1.317 -0.833 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.557 176.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 43.5 Cg_exo -57.92 -21.03 47.32 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.664 2.243 . . . . 0.0 112.407 179.121 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.14 16.06 15.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.514 -177.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.522 HD11 HD12 ' A' ' 27' ' ' LEU . 15.7 tt -72.23 154.76 7.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.691 0.281 . . . . 0.0 110.412 179.34 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 21.6 t -84.05 143.78 29.51 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.875 0.369 . . . . 0.0 110.683 -178.051 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -64.3 132.33 49.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.472 178.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.98 -33.69 3.73 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 121.047 -0.596 . . . . 0.0 111.754 -177.471 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.406 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 61.4 t80 -65.83 -35.84 81.81 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.369 0.604 . . . . 0.0 109.539 176.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' A' ' 24' ' ' ARG . 12.3 ttm180 -58.83 -43.11 90.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.047 174.087 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -66.1 -36.5 83.33 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.699 -179.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.412 ' O ' ' HG3' ' A' ' 30' ' ' MET . 39.4 ttm180 -67.93 -40.4 83.35 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.298 176.59 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.57 HD13 HD21 ' A' ' 69' ' ' LEU . 64.2 mt -65.04 -43.68 91.54 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.258 179.248 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -58.1 -46.47 85.48 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.224 175.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.8 t -61.16 -32.86 72.59 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.344 -0.843 . . . . 0.0 110.886 179.068 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.412 ' HG3' ' O ' ' A' ' 26' ' ' ARG . 89.4 mtp -74.65 -22.16 59.04 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.863 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 109.04 16.56 11.21 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.592 -0.813 . . . . 0.0 112.342 178.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.459 HD13 HD11 ' A' ' 69' ' ' LEU . 81.9 mt -104.04 96.96 7.01 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 178.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.47 ' HB2' ' HD2' ' A' ' 34' ' ' PRO . 1.8 pt? -135.67 161.09 64.98 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.342 -177.124 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.47 ' HD2' ' HB2' ' A' ' 33' ' ' LEU . 19.8 Cg_endo -59.8 131.43 39.8 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.43 2.087 . . . . 0.0 111.138 174.681 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.28 9.37 39.08 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.546 -0.835 . . . . 0.0 112.244 -178.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.553 ' O ' HG13 ' A' ' 12' ' ' ILE . . . -111.9 125.63 54.24 Favored 'General case' 0 N--CA 1.445 -0.72 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 177.35 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.471 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -99.75 138.69 36.48 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 121.12 0.486 . . . . 0.0 111.263 178.167 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 64.1 mt -119.44 141.63 48.95 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.396 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.487 ' HD3' ' HB3' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -99.32 154.08 18.46 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 173.607 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 12.5 p -95.97 128.54 47.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-O 121.314 0.578 . . . . 0.0 110.871 -177.045 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 92.8 t -88.06 -52.22 11.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.538 175.607 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 50.5 mtp180 -158.25 136.4 10.79 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.699 179.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.404 HD12 ' N ' ' A' ' 43' ' ' ILE . 4.2 mp -96.73 129.51 46.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 172.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.448 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -69.38 131.28 90.26 Favored Pre-proline 0 C--N 1.324 -0.505 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 176.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 20.1 Cg_exo -66.36 4.58 0.94 Allowed 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 123.053 2.502 . . . . 0.0 113.089 -176.026 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -101.29 -23.67 14.36 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.48 179.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 97.91 -15.9 61.02 Favored Glycine 0 N--CA 1.453 -0.182 0 N-CA-C 110.536 -1.026 . . . . 0.0 110.536 -171.388 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.628 ' CB ' ' HD2' ' A' ' 49' ' ' PRO . 0.6 OUTLIER -64.85 170.29 4.25 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 114.488 -0.856 . . . . 0.0 109.888 170.901 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.669 ' HD3' ' HD3' ' A' ' 62' ' ' ARG . 3.0 Cg_exo -30.75 151.1 0.02 OUTLIER 'Trans proline' 0 C--N 1.361 1.21 0 C-N-CA 125.197 3.931 . . . . 0.0 116.395 -164.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 74.2 mt -121.2 133.34 68.1 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 CA-C-N 113.939 -1.482 . . . . 0.0 109.784 -172.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -79.41 114.37 18.29 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 177.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 35.4 m -121.26 177.55 3.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 179.036 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.487 ' HB3' ' HD3' ' A' ' 39' ' ' ARG . 0.9 OUTLIER -138.66 140.36 38.82 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 -178.119 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 12.6 m -115.0 -32.52 5.72 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 112.219 0.451 . . . . 0.0 112.219 -171.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.602 ' HG3' ' HG2' ' A' ' 56' ' ' GLN . 14.4 tpt180 -178.97 -39.71 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.694 0.283 . . . . 0.0 111.388 -170.483 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.602 ' HG2' ' HG3' ' A' ' 55' ' ' ARG . 14.5 mm100 -130.25 -47.65 1.09 Allowed 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -169.704 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.6 t -144.19 161.03 39.9 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 120.765 0.317 . . . . 0.0 110.91 -172.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.4 m -68.99 146.71 52.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.357 -178.318 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 58.9 tp -131.21 144.88 51.67 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.905 178.579 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -123.99 122.27 37.46 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.846 0.355 . . . . 0.0 110.256 178.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.1 pp -122.44 140.15 53.05 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.039 179.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.669 ' HD3' ' HD3' ' A' ' 49' ' ' PRO . 19.3 mmt180 -67.12 170.06 7.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.449 0.642 . . . . 0.0 112.193 -175.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.4 ptm180 -60.88 -33.6 73.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.226 176.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -64.2 -49.29 72.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.625 175.432 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.463 ' OD1' ' HB2' ' A' ' 62' ' ' ARG . 4.3 m-20 -56.46 -40.82 75.48 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-O 121.223 0.535 . . . . 0.0 109.946 177.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 61.2 tp -58.42 -43.39 88.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.783 176.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -73.27 -12.68 60.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.551 -177.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.496 HD22 ' HA ' ' A' ' 19' ' ' ILE . 97.4 mt -96.8 -16.5 20.78 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.788 179.477 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.57 HD21 HD13 ' A' ' 27' ' ' LEU . 96.1 mt -116.15 118.94 34.22 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.894 0.378 . . . . 0.0 110.286 179.678 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.0 m -77.32 114.16 15.85 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.173 0.511 . . . . 0.0 110.049 -179.282 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.564 ' CD2' HG12 ' A' ' 12' ' ' ILE . 96.1 mt -118.59 127.62 53.77 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.453 -176.711 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 28.5 m -129.73 149.15 72.19 Favored Pre-proline 0 C--N 1.319 -0.74 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 174.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -65.97 163.39 31.29 Favored 'Trans proline' 0 N--CA 1.46 -0.46 0 C-N-CA 121.621 1.547 . . . . 0.0 111.398 177.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 89.3 mt -62.5 -41.87 99.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.164 0.507 . . . . 0.0 109.799 178.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 29.3 t70 . . . . . 0 C--O 1.248 0.994 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.476 175.819 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 18.2 m . . . . . 0 N--CA 1.435 -1.189 0 CA-C-O 120.884 0.373 . . . . 0.0 110.813 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.451 ' O ' HG12 ' A' ' 40' ' ' VAL . 35.3 mmt180 -137.26 174.57 10.47 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 121.455 0.645 . . . . 0.0 110.782 -176.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.467 ' HB2' ' CD1' ' A' ' 74' ' ' LEU . 51.1 m -113.53 133.44 55.24 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.078 172.079 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.4 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 60.5 m-85 -111.49 127.0 55.56 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -177.456 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.511 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 12.8 ptt180 -98.01 149.25 22.66 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.105 0.479 . . . . 0.0 110.625 -179.443 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.556 HG12 ' CD2' ' A' ' 71' ' ' LEU . 21.8 mt -90.34 118.63 36.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.007 -178.366 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 2.2 p -90.89 -12.24 36.76 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.96 0.41 . . . . 0.0 111.231 178.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.442 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 152.69 -164.81 30.84 Favored Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.717 -0.754 . . . . 0.0 111.912 176.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 48.0 m-85 -97.67 150.96 20.61 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 177.276 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.478 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 20.6 m -68.21 140.62 93.2 Favored Pre-proline 0 C--N 1.317 -0.828 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 177.088 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.478 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 23.6 Cg_exo -64.41 -0.89 3.27 Favored 'Trans proline' 0 CA--C 1.531 0.337 0 C-N-CA 123.047 2.498 . . . . 0.0 113.39 -175.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -105.41 17.24 24.25 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.862 0.363 . . . . 0.0 110.913 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.516 HG13 HD22 ' A' ' 68' ' ' LEU . 11.4 tt -93.73 159.76 2.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.619 -179.505 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 21.8 m -95.92 149.92 21.01 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.627 177.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -59.04 -48.7 80.63 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.411 -178.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.53 -37.16 91.76 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.959 -0.639 . . . . 0.0 112.421 -179.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.511 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 0.1 OUTLIER -72.05 -40.0 68.67 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.546 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 56.5 ttt-85 -57.08 -44.94 83.6 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.216 0.532 . . . . 0.0 110.378 175.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -62.62 -43.42 98.84 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.429 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 -61.92 -42.47 99.13 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.309 177.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.73 HD22 HD12 ' A' ' 32' ' ' LEU . 78.8 mt -66.27 -44.68 82.89 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.314 -179.246 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 42.5 t80 -60.65 -44.68 96.14 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.211 -179.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 54.3 m -67.5 -28.93 68.26 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.499 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 69.5 mtm -82.7 -18.99 38.92 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.744 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 119.17 12.2 7.06 Favored Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 120.156 -1.021 . . . . 0.0 113.546 175.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.73 HD12 HD22 ' A' ' 27' ' ' LEU . 94.3 mt -102.75 97.45 7.61 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.67 -0.492 . . . . 0.0 109.67 177.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.434 ' H ' HD23 ' A' ' 33' ' ' LEU . 1.9 pt? -131.22 152.13 80.06 Favored Pre-proline 0 N--CA 1.449 -0.502 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.89 -176.214 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.442 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 23.7 Cg_exo -64.11 136.2 50.91 Favored 'Trans proline' 0 N--CA 1.463 -0.289 0 C-N-CA 122.728 2.285 . . . . 0.0 111.723 177.039 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 108.98 -14.46 34.1 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.397 -178.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.84 -179.68 7.34 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-O 121.002 0.429 . . . . 0.0 110.094 178.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.511 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -150.69 138.76 20.12 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.954 -176.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.512 ' HB3' ' HB ' ' A' ' 52' ' ' VAL . 1.3 mm? -109.56 127.1 54.24 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.707 177.106 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 18.6 ttm180 -94.21 114.83 27.01 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 176.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.672 ' HA ' HG12 ' A' ' 52' ' ' VAL . 5.7 p -69.77 131.5 34.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.748 0.785 . . . . 0.0 111.858 -169.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.0 t -104.13 -36.86 4.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.723 177.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.2 ttm180 -168.17 140.09 2.91 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -177.493 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.545 HD11 HG21 ' A' ' 40' ' ' VAL . 4.5 mp -118.72 135.1 60.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 164.618 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.674 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -73.99 142.9 80.12 Favored Pre-proline 0 C--N 1.319 -0.718 0 C-N-CA 120.859 -0.336 . . . . 0.0 111.132 -179.296 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -64.9 -12.96 36.9 Favored 'Trans proline' 0 CA--C 1.529 0.274 0 C-N-CA 123.063 2.509 . . . . 0.0 112.138 177.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -59.34 -27.51 65.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.066 177.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.28 -75.03 0.24 Allowed Glycine 0 CA--C 1.494 -1.226 0 N-CA-C 110.493 -1.043 . . . . 0.0 110.493 -176.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -169.49 119.18 0.58 Allowed Pre-proline 0 N--CA 1.45 -0.473 0 CA-C-O 122.333 1.064 . . . . 0.0 112.712 173.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.674 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 55.2 Cg_endo -111.85 179.69 0.04 OUTLIER 'Trans proline' 0 N--CA 1.434 -1.998 1 C-N-CA 125.874 4.383 . . . . 0.0 106.718 136.657 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.868 HG22 HG13 ' A' ' 52' ' ' VAL . 8.4 mt -133.94 105.75 7.64 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.8 0 C-N-CA 118.205 -1.398 . . . . 0.0 110.673 176.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.507 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 25.0 tp60 -86.27 113.56 22.36 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 173.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.868 HG13 HG22 ' A' ' 50' ' ' ILE . 16.3 m -138.44 166.18 23.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-O 120.547 0.213 . . . . 0.0 111.101 -176.097 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -120.27 122.5 41.02 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 174.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.9 m -86.07 -78.96 0.26 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.871 -177.438 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.1 ptt180 -148.24 7.82 0.8 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.196 -179.236 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.3 tp60 -136.38 -64.81 0.59 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.123 0.487 . . . . 0.0 110.519 -172.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.1 t -153.22 -178.61 7.07 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 -179.059 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.506 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 26.6 m -78.9 143.03 36.27 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.345 0.593 . . . . 0.0 111.142 -179.158 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.507 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 6.3 mt -131.63 170.65 14.47 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.066 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.512 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -140.62 147.21 39.01 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.821 179.366 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.472 HD21 ' HB ' ' A' ' 50' ' ' ILE . 1.3 pt? -148.92 158.33 44.09 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.865 -0.421 . . . . 0.0 109.865 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 16.1 mmt180 -100.23 173.35 6.65 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.95 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.59 -34.88 65.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.041 -179.522 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 79.2 tttt -61.71 -51.6 67.72 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.852 0.358 . . . . 0.0 110.76 177.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.463 ' HB3' ' HB2' ' A' ' 61' ' ' LEU . 3.3 t70 -65.3 -38.66 90.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.501 0.667 . . . . 0.0 109.504 -178.525 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.585 HD22 HD11 ' A' ' 50' ' ' ILE . 59.0 tp -60.42 -39.13 86.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.138 176.19 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.02 -17.26 64.36 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.969 -176.303 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.516 HD22 HG13 ' A' ' 19' ' ' ILE . 86.2 mt -83.45 -25.7 30.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.0 0.429 . . . . 0.0 111.005 179.354 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.702 HD11 HD13 ' A' ' 32' ' ' LEU . 88.9 mt -109.69 131.78 54.74 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.712 -176.496 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.3 m -88.37 113.59 24.12 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 175.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.556 ' CD2' HG12 ' A' ' 12' ' ' ILE . 75.4 mt -115.82 132.45 56.64 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.506 -175.363 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.408 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 34.7 m -127.73 141.26 40.5 Favored Pre-proline 0 C--N 1.32 -0.684 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 174.311 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 72' ' ' VAL . 22.8 Cg_exo -64.65 162.29 32.02 Favored 'Trans proline' 0 C--O 1.233 0.257 0 C-N-CA 121.74 1.627 . . . . 0.0 112.343 179.392 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.467 ' CD1' ' HB2' ' A' ' 9' ' ' SER . 75.2 mt -70.31 -45.49 66.15 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.511 173.649 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 32.9 t70 . . . . . 0 C--O 1.244 0.801 0 CA-C-O 118.228 -0.892 . . . . 0.0 109.764 179.015 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 75.4 m . . . . . 0 N--CA 1.434 -1.236 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.404 ' H ' HG12 ' A' ' 40' ' ' VAL . 11.2 mpt_? -101.05 153.41 19.58 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.206 0.527 . . . . 0.0 111.506 -170.639 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.59 ' HA ' ' HA ' ' A' ' 39' ' ' ARG . 30.8 m -104.99 131.86 51.96 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.519 177.354 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.409 ' HE2' ' HB ' ' A' ' 40' ' ' VAL . 43.5 m-85 -115.21 132.33 56.64 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 -179.564 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.477 ' HG3' HG23 ' A' ' 72' ' ' VAL . 25.5 ptt180 -99.54 145.97 26.91 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.066 0.46 . . . . 0.0 110.994 -177.706 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.574 HG12 ' CD2' ' A' ' 71' ' ' LEU . 18.0 mt -93.53 119.26 41.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.281 -177.455 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 7.4 p -92.83 -19.06 22.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.8 0.333 . . . . 0.0 111.577 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.42 ' HA2' ' HB3' ' A' ' 34' ' ' PRO . . . 164.82 -151.84 21.09 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.099 179.301 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -115.58 152.84 32.3 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.882 0.372 . . . . 0.0 110.281 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.53 ' O ' HG22 ' A' ' 19' ' ' ILE . 49.2 m -78.83 150.76 75.87 Favored Pre-proline 0 N--CA 1.442 -0.846 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.497 179.433 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -70.48 11.25 0.49 Allowed 'Trans proline' 0 N--CA 1.474 0.379 0 C-N-CA 123.161 2.574 . . . . 0.0 113.598 -176.061 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -106.23 1.82 26.35 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.757 0.313 . . . . 0.0 111.04 179.02 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.53 HG22 ' O ' ' A' ' 16' ' ' SER . 16.4 tt -89.28 143.18 11.71 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 CA-C-O 120.942 0.401 . . . . 0.0 110.735 -179.053 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 21.2 t -156.41 -174.87 5.14 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 -178.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 61.37 -155.88 0.35 Allowed 'General case' 0 CA--C 1.537 0.472 0 O-C-N 123.467 0.48 . . . . 0.0 109.768 179.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -90.17 23.64 20.19 Favored Glycine 0 CA--C 1.519 0.289 0 C-N-CA 120.896 -0.668 . . . . 0.0 112.034 178.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.469 ' CE1' HD12 ' A' ' 68' ' ' LEU . 6.3 t80 -68.45 -38.0 80.72 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.865 0.365 . . . . 0.0 110.486 -176.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 15.5 ttm180 -64.62 -38.96 92.8 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.804 178.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -69.72 -32.22 70.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.733 179.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.3 tpp180 -65.59 -44.16 87.48 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 175.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.456 HD22 HD12 ' A' ' 32' ' ' LEU . 89.2 mt -66.84 -41.97 86.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.472 179.498 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -56.29 -44.76 80.17 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.274 177.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 50.8 m -61.6 -33.35 73.75 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.25 178.105 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 85.1 mtp -82.52 -11.76 58.24 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.37 -179.133 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 94.61 11.16 57.27 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.835 -0.697 . . . . 0.0 111.946 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.456 HD12 HD22 ' A' ' 27' ' ' LEU . 86.7 mt -92.2 90.08 7.16 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.278 0.561 . . . . 0.0 109.787 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.3 pp -145.32 161.05 43.36 Favored Pre-proline 0 C--N 1.321 -0.674 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.773 -175.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.42 ' HB3' ' HA2' ' A' ' 14' ' ' GLY . 14.7 Cg_endo -58.03 128.15 27.74 Favored 'Trans proline' 0 C--O 1.235 0.351 0 C-N-CA 122.861 2.374 . . . . 0.0 112.011 177.192 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 111.96 -14.19 26.5 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.953 -0.642 . . . . 0.0 111.631 -176.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.528 ' HB3' HD12 ' A' ' 12' ' ' ILE . . . -93.13 -179.86 5.21 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-O 121.114 0.483 . . . . 0.0 110.16 178.587 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -154.97 146.5 23.14 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.694 -177.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 57.1 mt -130.89 132.77 45.35 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.805 177.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.59 ' HA ' ' HA ' ' A' ' 9' ' ' SER . 79.5 ttt180 -100.06 127.44 46.29 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.304 -0.407 . . . . 0.0 109.953 178.687 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.458 ' HA ' HG12 ' A' ' 52' ' ' VAL . 5.1 p -66.53 120.84 14.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 121.254 0.549 . . . . 0.0 109.967 -179.37 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.822 ' HB ' ' HG2' ' A' ' 51' ' ' GLN . 43.0 t -92.62 -59.43 3.01 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.922 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.547 173.165 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 56.0 mtm180 -156.23 160.38 39.76 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.202 0.525 . . . . 0.0 112.099 -179.02 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 80.4 mt -129.62 135.11 62.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 172.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.543 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -71.84 153.79 92.97 Favored Pre-proline 0 C--N 1.327 -0.389 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -176.284 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 25.9 Cg_exo -63.61 -17.65 60.89 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 123.678 2.919 . . . . 0.0 113.499 -179.144 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 7.1 tt -46.99 -50.4 19.21 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.958 0.885 . . . . 0.0 109.985 175.374 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.92 -46.39 0.57 Allowed Glycine 0 N--CA 1.432 -1.624 0 N-CA-C 109.799 -1.321 . . . . 0.0 109.799 -172.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -174.42 117.36 0.34 Allowed Pre-proline 0 N--CA 1.449 -0.479 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 174.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.543 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 69.4 Cg_endo -115.65 -172.87 0.02 OUTLIER 'Trans proline' 0 N--CA 1.438 -1.753 1 C-N-CA 126.969 5.112 . . . . 0.0 106.637 132.43 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.734 HG22 HG13 ' A' ' 52' ' ' VAL . 50.8 mt -140.81 117.15 7.55 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.446 0 C-N-CA 118.866 -1.134 . . . . 0.0 111.24 175.898 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.822 ' HG2' ' HB ' ' A' ' 41' ' ' VAL . 32.4 tt0 -96.55 118.32 32.79 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.051 -0.977 . . . . 0.0 108.492 174.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.734 HG13 HG22 ' A' ' 50' ' ' ILE . 15.4 m -135.81 165.9 28.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.393 0.616 . . . . 0.0 112.212 -176.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -112.91 126.14 55.14 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.06 175.527 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.4 t -82.85 -28.33 30.18 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.04 178.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.49 -43.42 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 114.982 -1.008 . . . . 0.0 108.644 177.471 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -130.21 -37.1 1.47 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.705 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.7 t -106.83 158.76 16.75 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.738 -177.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.431 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 15.3 m -101.82 157.53 16.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.67 -177.26 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.52 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 8.7 mt -135.71 163.82 29.29 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.061 0.458 . . . . 0.0 111.465 179.121 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.569 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -140.73 135.51 31.63 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.333 175.098 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -159.49 178.65 9.67 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 -175.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.447 ' HA ' ' HD3' ' A' ' 62' ' ' ARG . 9.8 mmt85 -109.43 169.1 8.92 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.7 0.762 . . . . 0.0 112.299 179.516 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.1 ptp180 -60.81 -37.55 82.39 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.181 -1.372 . . . . 0.0 112.328 -174.501 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -59.81 -46.56 88.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.164 0.507 . . . . 0.0 110.678 178.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -66.48 -37.08 84.31 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.159 -176.29 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.573 HD22 ' CD1' ' A' ' 50' ' ' ILE . 4.6 tp -71.4 -38.71 71.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.692 176.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.07 -21.94 65.86 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.727 -0.669 . . . . 0.0 112.121 -175.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.469 HD12 ' CE1' ' A' ' 23' ' ' TYR . 60.5 mt -79.2 -12.71 59.97 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.456 -0.497 . . . . 0.0 110.555 177.144 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.403 HD11 HD13 ' A' ' 32' ' ' LEU . 82.2 mt -97.09 138.03 35.23 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 171.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 17.7 m -88.4 113.87 24.44 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 173.39 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.574 ' CD2' HG12 ' A' ' 12' ' ' ILE . 77.3 mt -116.86 134.1 55.19 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.907 -175.28 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.477 HG23 ' HG3' ' A' ' 11' ' ' ARG . 29.4 m -125.51 138.92 32.77 Favored Pre-proline 0 C--N 1.317 -0.825 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 172.026 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -65.04 165.02 22.89 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 121.669 1.579 . . . . 0.0 111.286 177.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 9' ' ' SER . 89.6 mt -51.9 -31.59 29.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.525 174.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 38.2 t70 . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.524 -0.751 . . . . 0.0 110.654 178.655 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.527 ' O ' ' HG3' ' A' ' 8' ' ' ARG . 36.5 t . . . . . 0 N--CA 1.452 -0.365 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.527 ' HG3' ' O ' ' A' ' 7' ' ' SER . 39.1 mtp85 -155.36 153.12 29.98 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 179.758 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.501 ' HB2' ' CD1' ' A' ' 74' ' ' LEU . 52.1 m -63.24 146.1 54.12 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.252 0.549 . . . . 0.0 111.058 -177.255 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -117.27 125.2 50.72 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.996 -177.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.553 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 26.2 ptt180 -95.01 154.18 17.29 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.069 0.461 . . . . 0.0 110.716 -178.217 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.502 HG12 ' CD2' ' A' ' 71' ' ' LEU . 18.4 mt -94.89 119.45 42.94 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.117 -177.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 4.5 p -94.46 -17.86 22.06 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.637 0.256 . . . . 0.0 111.254 179.012 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 1.001 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 161.32 -161.12 32.8 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.44 -0.886 . . . . 0.0 112.283 177.805 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 65.8 m-85 -110.47 156.39 20.92 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.605 -0.516 . . . . 0.0 109.605 177.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.482 ' O ' HG22 ' A' ' 19' ' ' ILE . 49.1 m -72.77 132.17 83.45 Favored Pre-proline 0 N--CA 1.442 -0.838 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 174.376 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -63.82 2.53 0.99 Allowed 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 123.325 2.683 . . . . 0.0 113.746 -174.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.01 -9.31 37.26 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.018 177.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.707 HD12 ' HB3' ' A' ' 68' ' ' LEU . 11.8 tt -84.49 143.54 11.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.107 0.48 . . . . 0.0 110.784 -178.247 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 41.2 m -84.12 158.24 21.45 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.354 177.355 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -63.74 -37.5 87.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.537 -173.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.47 ' O ' ' HB2' ' A' ' 25' ' ' GLN . . . -64.08 -41.27 98.55 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.679 -178.052 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -75.51 -32.87 60.67 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 178.427 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 40.3 ttt-85 -58.58 -35.39 72.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.437 172.469 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.47 ' HB2' ' O ' ' A' ' 22' ' ' GLY . 21.0 mt-30 -65.12 -33.5 76.17 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.621 177.231 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.6 tmm_? -66.01 -41.32 91.14 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.089 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 96.2 mt -69.1 -44.67 71.99 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.447 178.386 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -59.4 -43.94 92.91 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.83 179.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.4 m -63.59 -32.95 74.57 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.935 178.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 77.5 mtp -77.5 -15.82 59.08 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.094 178.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 95.29 15.87 42.68 Favored Glycine 0 N--CA 1.446 -0.681 0 C-N-CA 120.877 -0.678 . . . . 0.0 111.93 178.612 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.432 HD13 HD11 ' A' ' 69' ' ' LEU . 90.8 mt -92.69 79.44 4.79 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.62 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.6 pp -132.97 162.08 59.79 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.98 -173.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 1.001 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 35.2 Cg_exo -58.46 122.07 11.04 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.785 2.323 . . . . 0.0 112.119 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.46 -17.05 9.69 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.344 -179.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -94.6 -176.11 3.81 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 177.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -157.34 138.95 13.97 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.957 -177.633 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.425 ' N ' HD22 ' A' ' 38' ' ' LEU . 2.5 mm? -99.65 135.8 40.53 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 176.142 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.455 HH11 ' HD2' ' A' ' 39' ' ' ARG . 21.8 ttt180 -96.18 111.24 23.35 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.834 -178.423 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 7.8 p -60.48 127.08 19.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.438 0.637 . . . . 0.0 111.495 -177.424 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 49.6 t -103.55 -55.2 5.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.472 173.136 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 48.4 mtm180 -152.33 168.09 26.54 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.87 179.47 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.418 HG13 HG23 ' A' ' 50' ' ' ILE . 4.7 mp -124.49 139.37 50.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 174.049 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.469 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -68.82 135.29 89.99 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 120.633 0.254 . . . . 0.0 110.461 178.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.469 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 23.9 Cg_exo -65.74 -1.57 5.18 Favored 'Trans proline' 0 N--CA 1.475 0.419 0 C-N-CA 123.117 2.545 . . . . 0.0 113.195 -178.315 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -94.38 -16.94 23.03 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.812 179.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.48 ' O ' ' HD2' ' A' ' 63' ' ' ARG . . . 91.88 -9.53 76.5 Favored Glycine 0 N--CA 1.454 -0.15 0 N-CA-C 110.417 -1.073 . . . . 0.0 110.417 -171.178 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.878 ' HB3' ' HD2' ' A' ' 49' ' ' PRO . 6.5 m-20 -74.2 171.55 10.88 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 114.022 -1.089 . . . . 0.0 110.285 174.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.878 ' HD2' ' HB3' ' A' ' 48' ' ' ASP . 14.4 Cg_exo -24.43 152.13 0.0 OUTLIER 'Trans proline' 0 C--N 1.362 1.289 1 C-N-CA 126.316 4.678 . . . . 0.0 117.291 -167.665 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.509 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 71.0 mt -109.89 138.3 38.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-N 113.638 -1.619 . . . . 0.0 109.602 -171.345 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -86.72 108.92 18.89 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 35.8 m -121.18 -179.43 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.488 ' HA ' ' HA ' ' A' ' 58' ' ' SER . 34.0 tt0 -136.87 134.36 36.79 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 179.648 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.0 p -84.07 -45.86 12.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.325 0.583 . . . . 0.0 110.317 -177.105 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 28.8 ttm180 -161.8 -59.19 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.331 -0.849 . . . . 0.0 108.98 177.038 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -111.3 -39.27 4.75 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.308 177.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.8 t -103.06 149.87 24.15 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.912 0.387 . . . . 0.0 111.135 -172.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.488 ' HA ' ' HA ' ' A' ' 53' ' ' GLU . 21.3 m -95.17 152.09 18.65 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.576 179.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 53.1 tp -143.17 146.82 34.05 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.897 -177.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.509 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -112.28 124.82 53.3 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.95 176.658 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.66 HD13 HD13 ' A' ' 66' ' ' LEU . 1.3 pp -109.66 125.63 52.82 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.066 0.46 . . . . 0.0 110.584 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.438 ' HG3' ' HG3' ' A' ' 49' ' ' PRO . 2.9 mpt_? -67.24 171.98 5.24 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.068 -177.743 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.48 ' HD2' ' O ' ' A' ' 47' ' ' GLY . 0.0 OUTLIER -67.27 -44.52 79.13 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.589 179.445 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 60.0 tttp -70.71 -40.37 72.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.972 0.415 . . . . 0.0 110.324 177.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -63.75 -35.23 79.88 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.967 178.386 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.66 HD13 HD13 ' A' ' 61' ' ' LEU . 40.7 tp -68.81 -38.13 79.71 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.561 174.468 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.01 -15.43 63.02 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.903 -176.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.707 ' HB3' HD12 ' A' ' 19' ' ' ILE . 72.0 mt -83.87 -24.75 30.73 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.011 0.434 . . . . 0.0 110.751 177.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.432 HD11 HD13 ' A' ' 32' ' ' LEU . 87.8 mt -102.81 141.77 35.06 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.446 179.652 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.1 m -96.42 113.42 25.0 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 170.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.502 ' CD2' HG12 ' A' ' 12' ' ' ILE . 51.7 mt -121.19 137.1 54.83 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.628 -176.263 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 34.6 m -132.36 150.24 75.37 Favored Pre-proline 0 C--N 1.321 -0.653 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 174.053 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -60.21 163.75 13.95 Favored 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 121.863 1.708 . . . . 0.0 111.716 177.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.501 ' CD1' ' HB2' ' A' ' 9' ' ' SER . 74.8 mt -66.22 -12.17 54.48 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.022 175.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.3 t70 . . . . . 0 C--O 1.249 1.033 0 O-C-N 124.285 0.991 . . . . 0.0 110.311 -178.095 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 ptm . . . . . 0 N--CA 1.478 0.934 0 CA-C-O 120.573 0.225 . . . . 0.0 110.493 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.8 m -116.43 81.2 1.58 Allowed 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 175.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 65.24 176.84 0.2 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.253 -170.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.876 ' HB3' HG13 ' A' ' 41' ' ' VAL . 61.1 tp -146.12 99.02 3.19 Favored 'General case' 0 C--N 1.322 -0.618 0 O-C-N 122.229 -0.294 . . . . 0.0 110.567 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 53.21 72.27 1.2 Allowed Pre-proline 0 CA--C 1.531 0.238 0 O-C-N 124.037 0.835 . . . . 0.0 111.288 178.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -75.41 117.27 4.76 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 122.361 2.04 . . . . 0.0 112.074 -177.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 35.3 t -94.13 -48.77 6.06 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.87 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.464 ' O ' HG12 ' A' ' 40' ' ' VAL . 54.0 mtt180 -145.72 159.65 42.86 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.425 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.418 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 69.4 m -120.82 133.92 55.3 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.717 173.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.554 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 56.6 m-85 -114.35 129.21 56.64 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.666 -177.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.561 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 85.0 mtt180 -92.38 157.9 16.36 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.0 0.429 . . . . 0.0 110.692 178.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 51.8 mt -95.74 104.79 16.23 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 173.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.579 ' HB ' HG22 ' A' ' 72' ' ' VAL . 2.9 t -81.94 -14.61 55.86 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.128 0.49 . . . . 0.0 110.444 -175.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.731 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 157.93 -163.68 32.86 Favored Glycine 0 N--CA 1.442 -0.956 0 C-N-CA 120.886 -0.674 . . . . 0.0 112.038 179.308 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -97.71 153.38 18.28 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 88.7 p -74.38 162.17 74.95 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.869 -179.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_exo -71.39 -12.64 29.88 Favored 'Trans proline' 0 CA--C 1.529 0.229 0 C-N-CA 122.58 2.186 . . . . 0.0 112.095 174.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -89.12 -0.99 57.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.742 -178.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.455 HD11 ' CA ' ' A' ' 24' ' ' ARG . 18.6 tt -65.6 124.92 21.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.984 0.421 . . . . 0.0 110.017 179.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.5 m -138.77 159.35 42.34 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.848 -0.341 . . . . 0.0 111.876 -172.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 64.1 t30 60.46 41.19 16.22 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 115.549 -0.75 . . . . 0.0 112.687 168.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 70.19 21.97 77.28 Favored Glycine 0 C--N 1.331 0.261 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.988 174.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.516 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -65.88 -23.18 66.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.729 0.265 . . . . 0.0 111.294 179.823 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.455 ' CA ' HD11 ' A' ' 19' ' ' ILE . 6.0 ttm-85 -59.61 -36.3 76.05 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 121.342 0.592 . . . . 0.0 109.507 176.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -69.24 -36.42 77.16 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.781 179.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 25.2 tpp180 -67.01 -42.22 85.33 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 176.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 23' ' ' TYR . 84.1 mt -66.15 -43.13 87.87 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.232 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -61.55 -41.36 97.24 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.175 0.512 . . . . 0.0 110.242 178.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 63.3 m -60.47 -35.69 76.5 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.801 175.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 71.4 mtm -84.29 -11.52 56.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.613 -178.002 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 93.55 27.72 12.56 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.911 -0.662 . . . . 0.0 112.662 177.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.61 HD13 HD11 ' A' ' 69' ' ' LEU . 94.5 mt -105.74 102.77 12.2 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.083 0.468 . . . . 0.0 110.573 178.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.413 HD23 ' N ' ' A' ' 33' ' ' LEU . 1.8 pt? -138.02 157.11 73.63 Favored Pre-proline 0 N--CA 1.448 -0.574 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.225 -179.35 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.731 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 28.6 Cg_exo -62.13 136.8 62.6 Favored 'Trans proline' 0 C--O 1.233 0.275 0 C-N-CA 122.573 2.182 . . . . 0.0 111.92 178.05 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 114.69 -17.74 17.85 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.323 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -86.03 175.99 8.27 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-O 121.046 0.451 . . . . 0.0 110.215 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.561 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -148.56 148.18 29.88 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.045 -177.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 49.0 mt -122.7 130.24 52.72 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.084 178.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 14.5 ttm180 -98.13 119.6 37.07 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.41 178.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.491 ' HA ' HG12 ' A' ' 52' ' ' VAL . 13.4 p -61.3 127.3 20.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -171.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.876 HG13 ' HB3' ' A' ' 4' ' ' LEU . 76.1 t -98.0 -54.66 6.75 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 165.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.439 ' HB3' ' O ' ' A' ' 41' ' ' VAL . 15.9 ptt180 173.3 156.14 0.11 Allowed 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.359 0.6 . . . . 0.0 111.944 174.67 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.401 HG23 ' O ' ' A' ' 49' ' ' PRO . 84.4 mt -118.15 142.27 33.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 170.08 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.67 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -74.81 134.04 75.67 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-O 120.501 0.191 . . . . 0.0 110.556 176.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -66.8 -19.86 52.66 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 123.233 2.622 . . . . 0.0 112.999 -174.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 46' ' ' LEU . 4.0 mm? -51.48 -44.85 62.58 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.567 0.699 . . . . 0.0 110.509 176.541 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -174.97 -74.16 0.05 OUTLIER Glycine 0 N--CA 1.431 -1.651 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.328 -177.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.508 ' OD1' ' HD3' ' A' ' 63' ' ' ARG . 6.8 p-10 -177.97 127.16 0.28 Allowed Pre-proline 0 N--CA 1.442 -0.858 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 -179.088 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.67 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 73.5 Cg_endo -114.28 -168.2 0.02 OUTLIER 'Trans proline' 0 N--CA 1.43 -2.236 0 C-N-CA 124.482 3.455 . . . . 0.0 106.569 129.295 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.743 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 58.6 mt -145.1 99.9 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.35 0 C-N-CA 119.93 -0.708 . . . . 0.0 109.432 170.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.417 ' HA ' ' OE1' ' A' ' 51' ' ' GLN . 14.2 mm-40 -86.41 121.45 28.98 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 174.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.491 HG12 ' HA ' ' A' ' 40' ' ' VAL . 9.5 m -142.22 172.76 8.48 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.927 -179.047 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -122.22 150.82 41.75 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 177.078 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 29.3 p -120.11 -30.46 4.66 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -173.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 27.2 tpt180 178.61 -54.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.864 -175.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -143.82 4.79 1.32 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.568 -179.19 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.9 t -149.93 138.73 20.91 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.234 0.54 . . . . 0.0 111.063 -175.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.1 p -80.22 148.78 30.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.402 -178.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.582 HD13 ' N ' ' A' ' 60' ' ' ALA . 2.4 tm? -129.56 148.73 51.49 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.22 -0.445 . . . . 0.0 109.906 -178.366 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.743 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -139.72 148.11 41.85 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.969 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.585 HD11 HD12 ' A' ' 50' ' ' ILE . 3.9 pp -162.98 -179.18 6.56 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.543 -0.539 . . . . 0.0 109.543 -179.066 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 26.0 mmm-85 -110.83 170.06 8.35 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 122.03 0.919 . . . . 0.0 112.286 -177.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.508 ' HD3' ' OD1' ' A' ' 48' ' ' ASP . 18.1 ptt-85 -62.98 -35.17 79.28 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 113.771 -1.559 . . . . 0.0 111.455 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -71.52 -33.95 69.64 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.015 -178.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -75.31 -36.73 61.07 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.389 0.614 . . . . 0.0 109.536 176.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.622 HD11 HD11 ' A' ' 71' ' ' LEU . 37.6 tp -64.38 -30.39 71.43 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.737 175.028 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.09 -9.77 48.76 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.591 -178.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.482 ' HB3' HD11 ' A' ' 27' ' ' LEU . 63.6 mt -91.79 -5.38 53.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.041 0.448 . . . . 0.0 110.568 175.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.61 HD11 HD13 ' A' ' 32' ' ' LEU . 95.8 mt -119.83 153.75 35.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.952 -178.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 15.8 m -113.3 121.22 43.76 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.02 -0.537 . . . . 0.0 109.577 170.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.622 HD11 HD11 ' A' ' 66' ' ' LEU . 64.8 mt -103.46 146.37 28.62 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.263 0.554 . . . . 0.0 111.578 -175.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.579 HG22 ' HB ' ' A' ' 13' ' ' THR . 12.3 m -129.49 117.86 18.82 Favored Pre-proline 0 C--N 1.322 -0.63 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.669 173.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.554 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 7.9 Cg_exo -70.95 163.02 40.67 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 121.995 1.796 . . . . 0.0 111.728 -178.416 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 9' ' ' SER . 86.7 mt -58.33 -47.95 82.1 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 172.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 . . . . . 0 C--O 1.25 1.116 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.72 174.685 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.4 ptt? . . . . . 0 N--CA 1.481 1.124 0 CA-C-O 121.282 0.563 . . . . 0.0 110.682 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.8 m -159.71 -56.3 0.06 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.204 178.266 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 48.52 90.18 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.306 0 O-C-N 124.382 1.051 . . . . 0.0 113.173 175.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.402 HD13 ' HA ' ' A' ' 4' ' ' LEU . 3.7 mm? -70.84 -24.52 62.54 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 174.473 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 72.57 148.98 0.12 Allowed Pre-proline 0 N--CA 1.468 0.457 0 CA-C-N 115.106 -0.952 . . . . 0.0 112.144 176.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.51 ' HB3' ' O ' ' A' ' 40' ' ' VAL . 27.2 Cg_endo -63.84 110.06 1.22 Allowed 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.965 2.443 . . . . 0.0 112.059 177.357 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.516 ' HB3' ' HD3' ' A' ' 8' ' ' ARG . 22.9 t -99.23 -49.81 4.35 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.183 178.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.516 ' HD3' ' HB3' ' A' ' 7' ' ' SER . 0.0 OUTLIER -143.82 157.09 44.61 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.282 -179.864 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.424 ' HB2' ' CD1' ' A' ' 74' ' ' LEU . 15.3 m -105.1 164.13 12.04 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 176.021 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -127.87 132.84 49.33 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.865 -0.334 . . . . 0.0 110.989 -176.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.479 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 17.1 mtp180 -91.1 152.23 20.7 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.18 -0.464 . . . . 0.0 109.771 175.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.547 HG12 ' CD2' ' A' ' 71' ' ' LEU . 33.5 mt -102.9 117.62 48.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 176.495 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 2.9 p -87.34 -24.47 24.26 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.11 0.481 . . . . 0.0 110.74 177.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 165.62 -154.19 24.71 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.822 -0.704 . . . . 0.0 111.752 -179.185 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.473 ' CE1' ' HG3' ' A' ' 24' ' ' ARG . 44.9 m-85 -113.82 152.97 29.9 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 -177.016 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.435 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 20.9 m -70.35 140.21 87.47 Favored Pre-proline 0 C--N 1.319 -0.741 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.395 177.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 34.8 Cg_exo -61.57 -20.51 69.02 Favored 'Trans proline' 0 CA--C 1.529 0.265 0 C-N-CA 122.874 2.382 . . . . 0.0 112.22 179.524 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.68 29.24 2.37 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.933 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.521 HG13 HD22 ' A' ' 68' ' ' LEU . 19.8 tt -74.58 149.72 7.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.534 179.003 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.489 ' O ' ' HB2' ' A' ' 23' ' ' TYR . 9.3 m -89.43 117.94 28.72 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -173.153 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 24.47 88.15 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 115.407 1.632 . . . . 0.0 115.407 165.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.66 9.13 55.05 Favored Glycine 0 CA--C 1.517 0.176 0 N-CA-C 114.797 0.679 . . . . 0.0 114.797 171.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.489 ' HB2' ' O ' ' A' ' 20' ' ' SER . 0.9 OUTLIER -64.97 -23.06 67.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 117.75 0.775 . . . . 0.0 111.37 179.785 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.473 ' HG3' ' CE1' ' A' ' 15' ' ' TYR . 34.2 ttm180 -56.02 -46.58 78.75 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 121.165 0.507 . . . . 0.0 110.0 174.083 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -65.04 -34.48 78.54 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.996 -178.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 33.9 ttm180 -73.16 -39.85 65.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.157 178.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.515 HD22 HD12 ' A' ' 32' ' ' LEU . 95.3 mt -68.68 -43.57 75.84 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.26 -178.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -60.89 -42.44 97.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.248 179.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 69.9 m -67.4 -31.05 71.01 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.22 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.425 ' CE ' HD23 ' A' ' 27' ' ' LEU . 68.0 mtm -79.16 -27.67 42.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.233 179.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 124.48 4.51 7.52 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.32 -0.943 . . . . 0.0 112.857 177.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.543 HD13 HD11 ' A' ' 69' ' ' LEU . 92.1 mt -97.15 93.73 6.73 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 pp -139.05 159.05 68.38 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.615 -173.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.25 121.56 10.12 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.787 2.325 . . . . 0.0 112.08 177.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 114.74 -19.92 15.58 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 121.055 -0.593 . . . . 0.0 111.797 -176.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.492 ' O ' HG13 ' A' ' 12' ' ' ILE . . . -83.81 106.9 15.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.227 0.537 . . . . 0.0 110.46 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.479 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -88.58 116.33 26.75 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.772 177.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.49 HD13 HG21 ' A' ' 52' ' ' VAL . 70.5 mt -94.59 134.15 37.45 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.311 0.577 . . . . 0.0 110.236 -177.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 49.5 ttt180 -98.25 115.1 27.67 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.728 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.555 ' HA ' HG12 ' A' ' 52' ' ' VAL . 99.4 t -64.03 120.43 10.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 123.402 0.439 . . . . 0.0 111.275 -178.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.682 HG12 ' HG3' ' A' ' 42' ' ' ARG . 53.1 t -98.14 -53.56 7.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.52 174.171 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.682 ' HG3' HG12 ' A' ' 41' ' ' VAL . 25.7 mtp180 -148.46 140.12 23.66 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -173.279 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.2 mp -120.14 141.11 41.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 168.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.811 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -79.39 134.5 58.45 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-O 120.566 0.222 . . . . 0.0 110.868 176.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -64.64 -7.56 14.95 Favored 'Trans proline' 0 N--CA 1.479 0.636 0 C-N-CA 123.384 2.723 . . . . 0.0 113.159 -177.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.15 -37.93 81.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.593 0.711 . . . . 0.0 110.891 175.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.449 ' O ' ' HB2' ' A' ' 48' ' ' ASP . . . 174.3 -76.42 0.08 OUTLIER Glycine 0 N--CA 1.436 -1.332 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 -175.517 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.449 ' HB2' ' O ' ' A' ' 47' ' ' GLY . 17.2 t70 -179.58 118.37 0.22 Allowed Pre-proline 0 N--CA 1.453 -0.306 0 N-CA-C 113.658 0.985 . . . . 0.0 113.658 173.131 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.811 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 30.7 Cg_endo -111.49 160.77 0.05 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.441 1 C-N-CA 126.049 4.499 . . . . 0.0 108.835 139.309 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.667 HG22 HG13 ' A' ' 52' ' ' VAL . 2.7 mp -119.64 106.09 18.51 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.69 0 C-N-CA 118.89 -1.124 . . . . 0.0 110.028 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.535 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 0.8 OUTLIER -86.5 111.8 20.92 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 174.436 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.667 HG13 HG22 ' A' ' 50' ' ' ILE . 21.4 m -124.01 173.15 10.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.305 0.574 . . . . 0.0 111.922 -174.181 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -120.02 128.27 53.38 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.912 179.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.5 m -86.16 -40.01 16.08 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 173.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 26.2 ttp85 -179.63 -49.88 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.781 -1.099 . . . . 0.0 108.537 173.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -128.63 -24.22 3.04 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.095 174.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.8 t -93.12 138.95 31.08 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 121.131 0.491 . . . . 0.0 109.679 177.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 21.7 m -109.35 137.18 47.6 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.672 178.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.535 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 12.1 mt -123.84 152.13 42.64 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.98 -177.193 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.411 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -129.98 118.61 21.89 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 114.946 -1.025 . . . . 0.0 109.16 177.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.494 ' HB2' ' HB2' ' A' ' 65' ' ' ASP . 0.7 OUTLIER -124.26 150.05 45.78 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -174.74 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.574 ' HD3' ' N ' ' A' ' 62' ' ' ARG . 0.8 OUTLIER -97.89 176.43 5.79 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 120.953 0.406 . . . . 0.0 110.436 -176.154 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -54.01 -34.42 59.85 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.086 175.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.1 -45.72 90.14 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.981 177.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.494 ' HB2' ' HB2' ' A' ' 61' ' ' LEU . 5.1 m-20 -67.34 -41.68 84.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.064 178.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 62.1 tp -59.07 -37.82 77.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.822 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.97 -25.01 66.91 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.55 -178.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.521 HD22 HG13 ' A' ' 19' ' ' ILE . 81.8 mt -88.97 -15.83 33.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.236 -176.367 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.543 HD11 HD13 ' A' ' 32' ' ' LEU . 96.3 mt -110.33 143.2 40.91 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.965 0.412 . . . . 0.0 111.258 -175.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 20.4 m -101.57 114.1 27.84 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 172.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.547 ' CD2' HG12 ' A' ' 12' ' ' ILE . 75.0 mt -111.4 143.8 41.63 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.212 -174.517 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.497 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 16.3 m -126.37 123.77 24.24 Favored Pre-proline 0 C--N 1.317 -0.818 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.215 173.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.497 ' HD3' ' HA ' ' A' ' 72' ' ' VAL . 13.5 Cg_exo -70.01 161.48 45.82 Favored 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 122.201 1.934 . . . . 0.0 112.427 -175.407 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.424 ' CD1' ' HB2' ' A' ' 9' ' ' SER . 66.9 mt -74.89 -38.88 61.76 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.007 171.539 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.2 t70 . . . . . 0 C--O 1.25 1.096 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.211 -178.821 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.1 tmm? . . . . . 0 N--CA 1.477 0.888 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.9 m -109.31 129.27 55.52 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.346 179.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -83.05 80.42 9.05 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.181 0.515 . . . . 0.0 110.147 178.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.3 tt -101.61 117.84 35.73 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.474 -175.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -151.33 98.62 3.07 Favored Pre-proline 0 C--N 1.322 -0.628 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 174.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.538 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 68.0 Cg_endo -74.26 161.25 40.91 Favored 'Trans proline' 0 N--CA 1.462 -0.372 0 C-N-CA 122.908 2.405 . . . . 0.0 113.216 -172.481 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 31.8 t -122.36 -74.71 0.61 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.496 178.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.451 ' H ' HG12 ' A' ' 40' ' ' VAL . 47.1 mtp180 -128.64 167.68 16.84 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 120.816 0.341 . . . . 0.0 110.91 -178.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.52 ' HB2' HD12 ' A' ' 74' ' ' LEU . 21.7 m -121.93 142.89 49.82 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.058 0.456 . . . . 0.0 111.621 -173.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.46 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 73.2 m-85 -123.11 135.71 54.49 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.001 179.222 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.512 ' HG3' HG23 ' A' ' 72' ' ' VAL . 34.5 ptt180 -107.06 154.24 21.42 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.071 0.462 . . . . 0.0 110.48 179.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.444 HG12 ' CD2' ' A' ' 71' ' ' LEU . 26.6 mt -99.21 114.54 37.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.624 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 12.3 t -89.51 -18.44 26.66 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.755 0.312 . . . . 0.0 110.91 -177.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.575 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 167.39 -168.24 40.39 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.855 -0.688 . . . . 0.0 111.569 179.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -102.02 155.8 17.95 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.969 0.384 . . . . 0.0 110.315 177.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.502 ' O ' HG22 ' A' ' 19' ' ' ILE . 23.5 m -76.68 145.01 74.25 Favored Pre-proline 0 N--CA 1.442 -0.854 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.598 175.169 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 26.6 Cg_exo -62.91 0.39 1.61 Allowed 'Trans proline' 0 N--CA 1.477 0.512 0 C-N-CA 123.21 2.607 . . . . 0.0 114.088 -173.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.94 3.63 54.74 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.764 0.316 . . . . 0.0 111.151 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.502 HG22 ' O ' ' A' ' 16' ' ' SER . 15.4 tt -84.63 124.59 39.98 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-O 121.371 0.605 . . . . 0.0 110.793 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.2 m -156.12 -176.08 5.77 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.985 -177.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 66.2 t30 64.01 29.27 14.34 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 122.949 0.5 . . . . 0.0 112.06 170.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 81.8 5.56 89.72 Favored Glycine 0 N--CA 1.454 -0.166 0 C-N-CA 121.13 -0.557 . . . . 0.0 113.141 176.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -61.4 -26.46 67.87 Favored 'General case' 0 C--N 1.33 -0.262 0 O-C-N 122.704 -0.292 . . . . 0.0 111.631 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.462 ' HA ' HD11 ' A' ' 19' ' ' ILE . 12.3 ttm180 -64.97 -40.53 95.12 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.826 0.346 . . . . 0.0 110.198 178.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -61.66 -43.92 97.94 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.279 178.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -60.65 -42.88 97.86 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.296 178.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 75.7 mt -70.26 -41.59 73.27 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.497 -178.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -60.35 -46.41 90.03 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.261 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 74.5 m -65.59 -28.35 69.07 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.588 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 69.4 mtm -85.04 -9.26 58.18 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.959 178.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 96.34 24.44 14.31 Favored Glycine 0 C--N 1.33 0.218 0 C-N-CA 120.932 -0.651 . . . . 0.0 112.992 174.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.601 HD13 HD11 ' A' ' 69' ' ' LEU . 84.8 mt -112.28 94.09 4.76 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.897 0.379 . . . . 0.0 110.196 179.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.401 HD23 ' N ' ' A' ' 33' ' ' LEU . 1.8 pt? -137.96 159.61 67.85 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.381 -178.004 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.575 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 17.9 Cg_exo -66.23 138.73 52.49 Favored 'Trans proline' 0 N--CA 1.464 -0.256 0 C-N-CA 122.512 2.142 . . . . 0.0 111.495 177.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 100.65 -1.02 55.48 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.675 -0.774 . . . . 0.0 111.863 -177.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -103.43 -174.76 2.62 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 176.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.438 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -159.79 151.25 19.87 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.717 -176.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.578 HD13 HG21 ' A' ' 52' ' ' VAL . 85.4 mt -131.86 138.48 48.47 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.618 178.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 -110.37 127.43 55.06 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.924 -178.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.538 ' O ' ' HA ' ' A' ' 6' ' ' PRO . 8.5 p -65.5 126.04 23.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.351 0.596 . . . . 0.0 111.216 -175.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.651 HG12 ' HG3' ' A' ' 42' ' ' ARG . 65.2 t -96.83 -57.72 4.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.43 -0.804 . . . . 0.0 109.587 172.363 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.651 ' HG3' HG12 ' A' ' 41' ' ' VAL . 57.3 mtp180 -146.93 158.84 44.03 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.597 -179.189 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 61.2 mt -117.71 141.26 37.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.484 ' HB3' ' O ' ' A' ' 48' ' ' ASP . . . -72.21 150.8 92.21 Favored Pre-proline 0 C--O 1.233 0.222 0 CA-C-O 120.606 0.241 . . . . 0.0 110.859 178.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -54.89 -18.39 16.37 Favored 'Trans proline' 0 CA--C 1.535 0.534 0 C-N-CA 123.657 2.904 . . . . 0.0 114.854 -174.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 77.5 mt -103.41 -31.53 9.96 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 -175.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 118.18 -27.99 7.12 Favored Glycine 0 N--CA 1.453 -0.178 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 -171.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.784 ' HB3' ' HD2' ' A' ' 49' ' ' PRO . 0.2 OUTLIER -61.16 170.32 1.67 Allowed Pre-proline 0 C--O 1.221 -0.439 0 CA-C-O 118.346 -0.835 . . . . 0.0 109.113 168.47 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.784 ' HD2' ' HB3' ' A' ' 48' ' ' ASP . 17.1 Cg_exo -18.67 150.77 0.0 OUTLIER 'Trans proline' 0 C--N 1.362 1.273 1 C-N-CA 126.582 4.855 . . . . 0.0 117.988 -153.623 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 67.0 mt -123.91 140.37 47.56 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.971 0 CA-C-N 113.579 -1.646 . . . . 0.0 110.103 -170.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -84.37 112.63 20.51 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 178.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.578 HG21 HD13 ' A' ' 38' ' ' LEU . 26.7 m -119.41 168.92 11.15 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 120.738 0.304 . . . . 0.0 110.729 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -125.83 142.61 51.43 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.025 -176.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 11.8 m -96.87 -59.5 1.79 Allowed 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 172.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -141.65 -35.22 0.46 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.175 -0.92 . . . . 0.0 109.39 176.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -151.21 -35.06 0.14 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.775 173.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 2.0 m -67.25 135.04 52.78 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.914 -178.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.463 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 5.6 m -96.96 133.31 41.78 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.045 176.305 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.5 mp -115.98 148.08 40.5 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.281 -179.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -145.56 114.15 6.78 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.904 177.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.552 HD11 HD13 ' A' ' 66' ' ' LEU . 2.9 pp -135.96 153.6 51.36 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.592 -178.17 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.586 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 24.2 mmt180 -64.49 166.53 8.27 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.496 0.665 . . . . 0.0 112.02 -176.057 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 56.8 mtm180 -75.06 -32.94 61.65 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.045 178.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -58.33 -39.8 80.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.827 173.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -75.49 -40.13 57.66 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.601 178.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.695 HD11 HD11 ' A' ' 71' ' ' LEU . 26.9 tp -64.12 -26.62 68.62 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.779 179.614 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.89 -19.67 65.03 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.413 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 96.1 mt -73.47 -25.06 60.31 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.959 0.409 . . . . 0.0 110.545 178.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.601 HD11 HD13 ' A' ' 32' ' ' LEU . 75.7 mt -98.11 130.99 44.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.168 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 27.0 m -89.25 114.29 25.62 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 174.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.695 HD11 HD11 ' A' ' 66' ' ' LEU . 83.0 mt -110.74 144.2 40.07 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.284 -171.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.512 HG23 ' HG3' ' A' ' 11' ' ' ARG . 5.1 m -136.62 135.38 20.38 Favored Pre-proline 0 C--N 1.318 -0.762 0 CA-C-N 115.045 -0.979 . . . . 0.0 109.028 171.35 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.46 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 5.4 Cg_exo -72.93 162.83 40.01 Favored 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 121.897 1.732 . . . . 0.0 112.167 -177.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.52 HD12 ' HB2' ' A' ' 9' ' ' SER . 74.8 mt -82.81 -36.02 25.91 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 171.002 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 34.0 t70 . . . . . 0 C--O 1.253 1.26 0 CA-C-N 114.336 -1.302 . . . . 0.0 109.234 170.714 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.4 mmt . . . . . 0 N--CA 1.48 1.064 0 CA-C-O 121.019 0.438 . . . . 0.0 111.306 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.8 m -94.43 53.35 1.67 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.693 -170.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -86.98 95.95 10.1 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 173.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 63.6 tp -115.94 93.26 4.18 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.906 0.384 . . . . 0.0 111.211 -175.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -134.81 88.69 27.13 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.429 173.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -66.79 135.06 36.98 Favored 'Trans proline' 0 C--O 1.233 0.258 0 C-N-CA 122.562 2.175 . . . . 0.0 112.042 -178.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.457 ' HB3' HG11 ' A' ' 40' ' ' VAL . 22.8 t -80.54 -80.02 0.14 Allowed 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.789 -0.448 . . . . 0.0 109.789 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.446 ' O ' HG12 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -135.56 -179.93 5.95 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.936 0.398 . . . . 0.0 111.085 177.466 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.524 ' HB2' HD12 ' A' ' 74' ' ' LEU . 6.6 m -114.91 139.18 50.0 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.742 -177.112 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 36.3 m-85 -119.97 132.07 55.38 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.672 -178.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.432 ' HG3' HG23 ' A' ' 72' ' ' VAL . 1.9 ptp180 -96.68 148.72 22.59 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.025 0.441 . . . . 0.0 110.052 176.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.519 HD12 ' HB3' ' A' ' 36' ' ' ALA . 22.1 mt -92.91 114.3 29.45 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.14 -178.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 17.8 p -85.05 -22.58 28.93 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.946 0.403 . . . . 0.0 110.443 176.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 161.95 -150.35 19.65 Favored Glycine 0 N--CA 1.441 -0.972 0 C-N-CA 120.41 -0.9 . . . . 0.0 112.094 177.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -106.59 164.69 11.86 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 -179.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.416 ' HB2' ' O ' ' A' ' 67' ' ' ALA . 33.1 t -52.44 131.73 44.19 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 123.435 0.46 . . . . 0.0 110.767 175.388 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 20.7 Cg_exo -66.35 -5.01 11.67 Favored 'Trans proline' 0 C--N 1.343 0.245 0 C-N-CA 122.843 2.362 . . . . 0.0 112.243 178.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -122.09 26.42 8.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.71 178.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 18.4 tt -72.03 151.96 8.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 177.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 26.5 t -130.39 160.04 35.19 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 120.976 0.417 . . . . 0.0 111.77 -171.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.6 m120 63.77 -105.55 0.15 Allowed 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.923 172.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -148.68 27.61 1.32 Allowed Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.017 -177.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -65.74 -27.75 68.54 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 7.1 ttm180 -56.75 -42.64 79.68 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.383 175.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -68.68 -34.56 75.87 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.579 -178.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.1 tpp180 -61.94 -47.86 83.01 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.296 0.57 . . . . 0.0 109.749 173.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.408 HD13 HD21 ' A' ' 69' ' ' LEU . 97.8 mt -66.38 -41.77 88.91 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.53 -177.503 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -59.39 -45.22 92.06 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.558 -0.747 . . . . 0.0 110.32 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 45.9 m -65.01 -34.36 78.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.746 179.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.532 ' HA ' ' CE ' ' A' ' 30' ' ' MET . 10.3 mmt -73.1 -19.99 61.03 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.079 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 105.81 9.91 31.69 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.556 -0.831 . . . . 0.0 112.132 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.655 HD13 HD11 ' A' ' 69' ' ' LEU . 93.0 mt -98.52 97.94 9.19 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 178.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.8 pp -143.85 160.82 48.76 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.624 -176.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -60.96 133.25 46.36 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.513 2.142 . . . . 0.0 111.677 178.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 113.88 -17.15 20.4 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.328 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.519 ' HB3' HD12 ' A' ' 12' ' ' ILE . . . -93.27 -178.22 4.69 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-O 121.274 0.559 . . . . 0.0 110.323 179.14 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -149.1 151.88 35.19 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.287 -177.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 71.3 mt -129.24 138.17 51.51 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.211 0.529 . . . . 0.0 110.612 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 34.6 ttm180 -98.01 116.07 29.48 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.129 175.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.554 ' HA ' HG12 ' A' ' 52' ' ' VAL . 7.9 p -67.01 128.16 29.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.222 0.534 . . . . 0.0 110.337 -178.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.9 HG12 ' HG3' ' A' ' 42' ' ' ARG . 46.8 t -98.91 -53.9 7.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.243 178.066 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.9 ' HG3' HG12 ' A' ' 41' ' ' VAL . 46.3 mtt180 -157.43 138.21 13.2 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -173.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.6 mp -112.35 106.61 21.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 157.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.559 ' HB3' ' HD3' ' A' ' 49' ' ' PRO . . . -53.16 128.89 49.53 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 120.582 0.23 . . . . 0.0 111.387 -173.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -61.25 -6.41 6.6 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 123.465 2.777 . . . . 0.0 112.666 -179.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.443 HD13 ' HA ' ' A' ' 46' ' ' LEU . 3.7 mm? -58.82 -34.53 71.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.343 172.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 164.9 -76.29 0.15 Allowed Glycine 0 CA--C 1.494 -1.235 0 N-CA-C 109.862 -1.295 . . . . 0.0 109.862 -175.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -176.19 119.92 0.3 Allowed Pre-proline 0 N--CA 1.449 -0.477 0 N-CA-C 114.266 1.21 . . . . 0.0 114.266 171.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.559 ' HD3' ' HB3' ' A' ' 44' ' ' ALA . 55.2 Cg_endo -115.47 166.32 0.03 OUTLIER 'Trans proline' 0 N--CA 1.438 -1.774 1 C-N-CA 125.736 4.291 . . . . 0.0 109.159 134.869 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.604 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 59.5 mt -116.84 100.32 10.09 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.703 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.979 179.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.492 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 35.8 mt-30 -92.74 115.38 28.06 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.423 179.605 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.554 HG12 ' HA ' ' A' ' 40' ' ' VAL . 19.8 m -131.53 171.92 17.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.486 -177.208 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -134.63 133.62 40.33 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 17.9 m -82.95 -73.02 0.42 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.779 0.323 . . . . 0.0 111.071 -177.08 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.474 ' HD2' ' O ' ' A' ' 55' ' ' ARG . 7.4 tmm_? -167.82 23.36 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.435 ' HB2' ' O ' ' A' ' 55' ' ' ARG . 8.4 tt0 171.59 -29.76 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.553 -175.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.5 t -130.24 143.93 51.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.146 -175.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 34.7 t -103.31 146.24 28.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.386 0.612 . . . . 0.0 110.762 -178.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.492 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 2.7 mm? -128.32 166.96 17.63 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.161 -178.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.604 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -149.39 133.94 17.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.85 179.129 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -151.59 174.34 13.56 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -175.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.491 ' N ' ' HD2' ' A' ' 62' ' ' ARG . 8.4 mpt_? -104.88 167.1 9.93 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 120.891 0.376 . . . . 0.0 111.363 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -43.98 -56.71 3.77 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 115.08 -0.964 . . . . 0.0 112.902 177.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -56.0 -40.12 72.89 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.272 0.558 . . . . 0.0 111.149 -176.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -70.76 -31.23 67.96 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.166 -176.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.472 HD11 HD12 ' A' ' 71' ' ' LEU . 18.2 tp -68.26 -39.49 82.18 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.295 176.408 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.416 ' O ' ' HB2' ' A' ' 16' ' ' SER . . . -63.91 -14.11 50.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.859 -177.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 83.8 mt -80.33 -16.49 54.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.985 0.421 . . . . 0.0 110.68 177.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.655 HD11 HD13 ' A' ' 32' ' ' LEU . 80.2 mt -109.2 151.35 26.6 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.018 176.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 26.3 m -107.5 114.26 28.15 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.351 0.596 . . . . 0.0 109.996 172.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.511 ' CD2' HG12 ' A' ' 12' ' ' ILE . 58.7 mt -122.45 137.48 54.86 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.162 -0.927 . . . . 0.0 110.335 -175.277 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.435 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 27.6 m -127.91 137.04 29.95 Favored Pre-proline 0 C--N 1.322 -0.605 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 174.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.497 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 13.6 Cg_exo -68.32 163.15 37.47 Favored 'Trans proline' 0 N--CA 1.463 -0.319 0 C-N-CA 122.124 1.883 . . . . 0.0 111.911 -178.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.524 HD12 ' HB2' ' A' ' 9' ' ' SER . 78.8 mt -79.43 -37.02 38.04 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.359 0.6 . . . . 0.0 110.156 175.078 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 29.7 t70 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.269 -0.872 . . . . 0.0 109.882 177.879 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.0 ptt? . . . . . 0 N--CA 1.478 0.943 0 N-CA-C 110.309 -0.256 . . . . 0.0 110.309 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 63.8 m 69.12 150.87 0.08 Allowed 'General case' 0 C--O 1.233 0.225 0 O-C-N 123.936 0.773 . . . . 0.0 111.769 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -109.51 96.23 6.14 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.784 -179.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 88.4 mt -88.8 -80.48 0.29 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.341 177.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 58.05 77.62 0.4 Allowed Pre-proline 0 N--CA 1.465 0.322 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.562 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.35 129.55 17.16 Favored 'Trans proline' 0 C--O 1.233 0.273 0 C-N-CA 122.53 2.153 . . . . 0.0 112.066 179.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 36.6 t -77.33 -68.13 0.65 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.548 178.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.4 ' O ' HG12 ' A' ' 40' ' ' VAL . 53.5 mtp180 -135.44 161.49 35.32 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.046 0.451 . . . . 0.0 110.839 -176.121 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.535 ' HB2' HD12 ' A' ' 74' ' ' LEU . 19.8 m -118.51 141.83 48.19 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.796 179.011 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.528 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 4.6 m-85 -130.02 133.11 46.52 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.25 -174.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.603 ' HG2' ' HB2' ' A' ' 37' ' ' ALA . 55.7 mtt-85 -89.1 159.03 17.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.071 0.462 . . . . 0.0 110.751 177.092 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 40.0 mt -100.55 111.39 30.09 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.07 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.24 -27.21 53.24 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.458 0.647 . . . . 0.0 110.256 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.568 ' HA2' ' HB3' ' A' ' 34' ' ' PRO . . . 153.61 -149.83 21.4 Favored Glycine 0 N--CA 1.441 -0.975 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.481 -177.498 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.607 ' CE1' ' HG3' ' A' ' 24' ' ' ARG . 19.5 m-85 -118.11 151.62 37.2 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 -179.307 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.523 ' O ' HG22 ' A' ' 19' ' ' ILE . 25.2 m -64.4 143.05 98.48 Favored Pre-proline 0 N--CA 1.447 -0.581 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 178.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 26.0 Cg_exo -62.69 -0.42 1.97 Allowed 'Trans proline' 0 CA--C 1.532 0.424 0 C-N-CA 123.268 2.646 . . . . 0.0 113.901 -173.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.75 -6.59 39.38 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.755 0.312 . . . . 0.0 111.463 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.523 HG22 ' O ' ' A' ' 16' ' ' SER . 12.7 tt -88.01 148.51 4.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 120.974 0.416 . . . . 0.0 110.647 -177.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.511 ' HB3' ' HD2' ' A' ' 23' ' ' TYR . 13.2 t -89.33 162.81 15.62 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.957 179.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -69.71 -40.59 76.17 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 -173.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.39 -33.94 86.43 Favored Glycine 0 CA--C 1.517 0.214 0 C-N-CA 120.422 -0.894 . . . . 0.0 112.037 177.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.511 ' HD2' ' HB3' ' A' ' 20' ' ' SER . 41.1 m-85 -67.15 -38.75 86.05 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 120.782 0.325 . . . . 0.0 110.319 175.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.607 ' HG3' ' CE1' ' A' ' 15' ' ' TYR . 20.2 ttm180 -59.24 -43.34 92.38 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.899 175.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -64.42 -37.14 86.5 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.368 -178.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 62.2 ttt180 -72.38 -36.53 68.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.207 178.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.423 HD23 ' HE3' ' A' ' 30' ' ' MET . 73.8 mt -68.76 -43.37 75.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.411 179.038 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -58.78 -45.39 89.92 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.92 178.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 64.9 m -64.32 -31.6 72.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.588 179.37 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.423 ' HE3' HD23 ' A' ' 27' ' ' LEU . 71.7 mtm -81.33 -15.11 56.34 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.692 -179.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 116.96 6.92 13.43 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.406 -0.902 . . . . 0.0 113.611 174.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.4 mt -105.42 98.02 7.78 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 178.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.437 ' H ' HD23 ' A' ' 33' ' ' LEU . 1.9 pt? -128.95 150.76 76.14 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.258 -174.538 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.568 ' HB3' ' HA2' ' A' ' 14' ' ' GLY . 37.9 Cg_endo -66.23 135.01 38.46 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.807 2.338 . . . . 0.0 111.534 178.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 107.16 -19.73 34.3 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.332 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.32 -171.41 3.56 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-O 121.327 0.584 . . . . 0.0 110.57 -178.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.603 ' HB2' ' HG2' ' A' ' 11' ' ' ARG . . . -148.22 135.9 20.76 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.287 -177.13 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.495 HD13 HG21 ' A' ' 52' ' ' VAL . 51.0 mt -108.8 131.88 54.54 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.159 0.504 . . . . 0.0 110.523 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 6.4 ttp85 -101.94 123.43 45.85 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.321 -0.854 . . . . 0.0 108.831 175.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.608 ' HA ' HG12 ' A' ' 52' ' ' VAL . 10.8 p -69.13 127.2 30.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 121.405 0.622 . . . . 0.0 111.391 -175.308 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.5 t -88.44 -50.64 13.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.761 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.927 174.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 38.9 ttm180 -175.18 142.97 0.65 Allowed 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.192 0.52 . . . . 0.0 112.033 -178.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 98.0 mt -100.86 140.57 19.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 168.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.796 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -82.64 147.93 56.86 Favored Pre-proline 0 C--N 1.324 -0.528 0 O-C-N 122.247 -0.283 . . . . 0.0 111.087 -178.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -67.18 -2.05 7.37 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 123.25 2.633 . . . . 0.0 112.915 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.446 ' HA ' HD22 ' A' ' 46' ' ' LEU . 1.0 OUTLIER -56.57 -38.92 72.63 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 122.153 0.978 . . . . 0.0 109.448 174.921 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.55 ' O ' ' HB2' ' A' ' 48' ' ' ASP . . . 153.18 -55.0 0.44 Allowed Glycine 0 N--CA 1.434 -1.489 0 N-CA-C 108.289 -1.924 . . . . 0.0 108.289 -170.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.55 ' HB2' ' O ' ' A' ' 47' ' ' GLY . 13.0 t70 169.24 120.31 0.04 OUTLIER Pre-proline 0 N--CA 1.452 -0.373 0 O-C-N 125.155 1.15 . . . . 0.0 113.075 168.318 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.796 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 27.8 Cg_endo -109.94 163.53 0.07 OUTLIER 'Trans proline' 0 N--CA 1.433 -2.038 1 C-N-CA 125.307 4.005 . . . . 0.0 108.097 137.324 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.819 HG22 HG13 ' A' ' 52' ' ' VAL . 30.8 mt -115.87 103.97 16.02 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 C-N-CA 119.31 -0.956 . . . . 0.0 110.672 -177.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.462 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 97.9 mt-30 -84.63 113.17 21.08 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 173.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.819 HG13 HG22 ' A' ' 50' ' ' ILE . 15.5 m -132.98 165.68 31.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 120.887 0.375 . . . . 0.0 111.481 -177.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -147.26 141.04 25.72 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.523 -0.918 . . . . 0.0 108.523 176.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 8.9 t -95.89 -47.7 6.03 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.169 -0.612 . . . . 0.0 109.699 176.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 55' ' ' ARG . 13.9 ptt180 177.24 24.04 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.474 0.71 . . . . 0.0 109.554 175.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -127.32 -65.71 0.92 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.082 -172.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.3 t -164.47 153.73 13.47 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.052 -178.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.403 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 10.5 m -71.89 141.39 49.54 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.135 0.493 . . . . 0.0 111.139 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.462 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 65.8 tp -139.9 144.6 37.23 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.031 178.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.419 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -112.56 141.39 46.38 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.605 179.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.59 HD11 HD12 ' A' ' 50' ' ' ILE . 4.0 pp -142.29 161.43 38.05 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 -179.208 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.677 ' HD3' ' OD2' ' A' ' 65' ' ' ASP . 2.8 mpt_? -96.75 175.37 6.39 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.005 0.431 . . . . 0.0 109.979 -177.22 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.1 mmt180 -66.2 -33.52 75.95 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.508 177.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -66.87 -35.3 79.7 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.664 177.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.677 ' OD2' ' HD3' ' A' ' 62' ' ' ARG . 41.4 m-20 -68.23 -42.5 79.64 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-O 121.422 0.629 . . . . 0.0 109.366 175.111 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 45.5 tp -60.21 -32.37 71.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.875 178.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.84 -21.57 66.48 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.453 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 89.6 mt -86.03 -18.61 32.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.92 0.39 . . . . 0.0 110.996 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 88.7 mt -104.39 141.85 35.61 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.709 -177.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 20.2 m -101.29 115.67 31.03 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 172.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 73.2 mt -117.83 147.69 42.81 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.246 -176.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.424 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 4.6 m -128.26 115.33 20.02 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.645 172.287 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.528 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 21.9 Cg_exo -65.31 161.62 36.94 Favored 'Trans proline' 0 N--CA 1.464 -0.251 0 C-N-CA 122.134 1.889 . . . . 0.0 112.323 -177.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.535 HD12 ' HB2' ' A' ' 9' ' ' SER . 97.6 mt -93.56 -15.48 25.4 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 121.341 0.591 . . . . 0.0 109.705 176.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.4 t70 . . . . . 0 C--O 1.244 0.809 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.407 176.739 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.5 mtt . . . . . 0 N--CA 1.482 1.13 0 CA-C-O 120.685 0.279 . . . . 0.0 110.41 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.6 p -177.71 35.66 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.135 -178.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.52 72.76 6.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.346 -175.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.7 pp -162.47 159.16 24.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.147 0.499 . . . . 0.0 111.229 178.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -151.85 77.01 7.17 Favored Pre-proline 0 C--N 1.322 -0.608 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 177.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -83.89 149.13 12.36 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 122.478 2.119 . . . . 0.0 112.069 -178.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.6 t -166.16 -61.76 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.868 0.366 . . . . 0.0 111.079 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -103.71 173.21 6.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.621 0.724 . . . . 0.0 112.057 -172.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.446 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 13.4 t -137.92 140.42 40.3 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.66 172.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.404 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 19.3 m-85 -123.87 129.11 50.47 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.261 -175.424 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.421 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 36.3 mtt-85 -88.96 146.84 24.64 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 177.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.516 HG12 ' CD2' ' A' ' 71' ' ' LEU . 36.7 mt -90.91 111.59 23.88 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 175.429 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 18.5 m -79.08 -22.24 45.58 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.341 0.591 . . . . 0.0 110.336 178.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.655 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 156.94 -142.78 8.96 Favored Glycine 0 N--CA 1.443 -0.873 0 C-N-CA 120.834 -0.698 . . . . 0.0 111.785 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.577 ' HB3' HG21 ' A' ' 19' ' ' ILE . 34.0 m-85 -121.82 151.16 40.92 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.64 ' O ' HG22 ' A' ' 19' ' ' ILE . 74.3 p -69.59 159.16 84.89 Favored Pre-proline 0 N--CA 1.445 -0.68 0 CA-C-O 120.683 0.278 . . . . 0.0 111.002 -177.226 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_exo -73.44 11.57 0.99 Allowed 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 122.533 2.155 . . . . 0.0 111.961 174.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -103.77 -14.26 16.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.766 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.64 HG22 ' O ' ' A' ' 16' ' ' SER . 13.0 tt -89.43 142.96 12.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 120.77 0.319 . . . . 0.0 110.166 179.572 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.7 t -161.36 -174.69 4.41 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.624 0.25 . . . . 0.0 110.368 -174.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.1 t30 59.15 34.91 23.49 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.284 0.634 . . . . 0.0 111.793 174.061 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.39 6.0 87.84 Favored Glycine 0 CA--C 1.519 0.293 0 C-N-CA 120.838 -0.696 . . . . 0.0 114.011 174.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -62.22 -22.83 66.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 117.31 0.555 . . . . 0.0 110.889 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.494 ' HG2' ' CG ' ' A' ' 15' ' ' TYR . 34.6 mtt85 -63.95 -42.84 97.18 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.746 174.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -66.88 -35.79 80.83 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 121.231 0.539 . . . . 0.0 109.802 177.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 86.1 mtt180 -62.13 -44.14 97.28 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.814 176.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.612 HD22 HD12 ' A' ' 32' ' ' LEU . 38.2 mt -69.56 -41.71 75.5 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.493 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -58.14 -47.44 83.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.415 178.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 59.3 m -63.34 -28.68 70.17 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.571 -179.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.422 ' HE3' HD23 ' A' ' 27' ' ' LEU . 67.9 mtm -84.71 -12.99 52.68 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.424 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 114.76 -0.28 23.1 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.471 -0.871 . . . . 0.0 113.261 174.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.821 HD13 HD11 ' A' ' 69' ' ' LEU . 88.7 mt -96.05 100.44 12.1 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.968 0.413 . . . . 0.0 110.107 -178.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 pp -138.89 155.42 73.09 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.069 -175.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.655 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 23.0 Cg_exo -64.4 137.61 56.39 Favored 'Trans proline' 0 C--O 1.234 0.308 0 C-N-CA 122.9 2.4 . . . . 0.0 112.052 179.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 111.04 -28.12 10.14 Favored Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.313 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.03 154.08 21.04 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-O 121.122 0.486 . . . . 0.0 110.105 -179.041 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.421 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -129.94 138.17 50.74 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.973 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.65 ' HB3' ' HB ' ' A' ' 52' ' ' VAL . 2.2 mm? -106.87 142.19 36.9 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.268 179.803 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 35.5 ttt180 -94.16 132.85 38.28 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 173.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.591 ' HA ' HG12 ' A' ' 52' ' ' VAL . 7.6 p -71.64 128.28 34.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.157 0.504 . . . . 0.0 111.084 -175.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.0 t -99.35 -44.87 11.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.611 176.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 57.9 ttt180 -176.52 135.79 0.25 Allowed 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 -177.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.424 HG23 ' HD2' ' A' ' 49' ' ' PRO . 4.8 mp -116.6 128.76 73.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 166.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.428 ' H ' ' CD ' ' A' ' 49' ' ' PRO . . . -67.12 125.49 91.05 Favored Pre-proline 0 C--N 1.32 -0.675 0 C-N-CA 121.048 -0.261 . . . . 0.0 110.442 176.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -57.36 -14.45 15.98 Favored 'Trans proline' 0 N--CA 1.475 0.428 0 C-N-CA 123.426 2.751 . . . . 0.0 113.107 -179.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -54.92 -33.24 61.95 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.315 176.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 164.37 -75.64 0.16 Allowed Glycine 0 N--CA 1.435 -1.419 0 N-CA-C 110.981 -0.848 . . . . 0.0 110.981 -177.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -164.68 118.53 0.99 Allowed Pre-proline 0 N--CA 1.443 -0.818 0 N-CA-C 114.522 1.304 . . . . 0.0 114.522 179.364 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.428 ' CD ' ' H ' ' A' ' 44' ' ' ALA . 82.3 Cg_endo -118.61 -175.5 0.02 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.714 1 C-N-CA 126.994 5.129 . . . . 0.0 107.988 132.738 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.509 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 67.3 mt -145.11 104.43 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.237 0 C-N-CA 120.117 -0.633 . . . . 0.0 109.882 173.253 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.443 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 8.9 tt0 -92.96 120.64 33.49 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 174.233 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.65 ' HB ' ' HB3' ' A' ' 38' ' ' LEU . 7.6 m -140.53 162.02 23.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.777 0.322 . . . . 0.0 111.025 -176.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -119.12 135.61 54.57 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.024 -0.534 . . . . 0.0 109.689 -178.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.0 t -88.91 -33.12 17.4 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.704 -0.399 . . . . 0.0 110.044 179.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 35.1 ttm180 178.24 -61.25 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.308 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -107.31 -38.33 5.99 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.513 178.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.0 t -109.0 150.2 28.1 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.901 0.381 . . . . 0.0 110.845 -174.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.2 p -114.38 144.91 42.53 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.649 179.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.443 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 6.2 mp -127.45 162.01 27.38 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.987 -176.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.509 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -131.41 142.18 49.98 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.858 177.097 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.498 HD13 ' HB2' ' A' ' 65' ' ' ASP . 3.9 pp -153.82 177.34 11.11 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 -174.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.409 ' HD2' ' O ' ' A' ' 61' ' ' LEU . 15.1 mmm-85 -121.92 -175.04 3.02 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.931 0.872 . . . . 0.0 111.521 -178.673 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.0 ptp180 -56.04 -34.0 65.47 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 113.757 -1.565 . . . . 0.0 111.669 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -63.11 -44.61 95.15 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.478 179.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.498 ' HB2' HD13 ' A' ' 61' ' ' LEU . 7.7 m-20 -67.63 -39.45 84.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.246 0.546 . . . . 0.0 109.601 178.122 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 66.3 tp -60.03 -39.64 86.58 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.289 -0.868 . . . . 0.0 110.878 177.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.45 -12.84 61.61 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.231 -0.441 . . . . 0.0 112.118 -176.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.497 ' HB3' HD12 ' A' ' 19' ' ' ILE . 93.8 mt -93.32 -21.33 19.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.79 0.329 . . . . 0.0 110.81 179.459 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.821 HD11 HD13 ' A' ' 32' ' ' LEU . 96.9 mt -107.25 140.32 40.32 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.463 -175.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.5 m -91.27 112.29 24.14 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 169.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.516 ' CD2' HG12 ' A' ' 12' ' ' ILE . 82.6 mt -120.92 128.05 52.41 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.307 -174.485 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.417 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 34.9 m -124.93 133.03 24.45 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.119 176.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 72' ' ' VAL . 18.5 Cg_exo -65.04 163.29 29.2 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.087 1.858 . . . . 0.0 111.414 179.223 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 9' ' ' SER . 91.3 mt -53.81 -57.62 10.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.216 0.531 . . . . 0.0 109.714 173.562 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.6 t70 . . . . . 0 C--O 1.251 1.132 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.416 176.413 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.8 tpt . . . . . 0 N--CA 1.483 1.201 0 CA-C-O 120.764 0.316 . . . . 0.0 110.355 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.5 m -117.3 113.64 22.44 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.351 179.054 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -86.74 156.5 19.91 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.588 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.8 tt 61.64 98.28 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.365 0 O-C-N 123.928 0.767 . . . . 0.0 110.263 -176.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.404 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 12.4 pt20 -125.66 125.39 24.97 Favored Pre-proline 0 C--N 1.321 -0.674 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.473 -179.16 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 5' ' ' GLN . 23.9 Cg_exo -62.9 118.89 5.79 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 122.443 2.095 . . . . 0.0 110.655 175.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.0 t -106.93 -63.07 1.32 Allowed 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.597 -170.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 47.8 ttt85 -111.12 144.57 40.05 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.56 -171.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.1 t -123.21 139.78 53.7 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.925 -178.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.648 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 8.3 m-85 -116.66 133.19 56.31 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -178.307 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.456 ' CZ ' HD23 ' A' ' 74' ' ' LEU . 11.2 ptp180 -102.73 157.91 16.62 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 175.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.493 HG12 ' CD2' ' A' ' 71' ' ' LEU . 19.6 mt -104.66 115.04 45.81 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.131 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.018 -178.381 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 1.5 p -93.05 -16.27 25.19 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.664 0.269 . . . . 0.0 111.255 178.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.541 ' HA2' ' HB3' ' A' ' 34' ' ' PRO . . . 165.13 -153.84 24.24 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.487 -0.863 . . . . 0.0 112.28 178.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.52 ' CE1' ' HD3' ' A' ' 34' ' ' PRO . 60.9 m-85 -119.86 153.32 36.0 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 -178.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.591 ' O ' HG22 ' A' ' 19' ' ' ILE . 29.2 m -67.89 138.47 92.85 Favored Pre-proline 0 N--CA 1.441 -0.875 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 176.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -65.98 6.82 0.42 Allowed 'Trans proline' 0 CA--C 1.532 0.415 0 C-N-CA 122.771 2.314 . . . . 0.0 113.481 -175.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -106.39 7.77 31.29 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.705 179.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.591 HG22 ' O ' ' A' ' 16' ' ' SER . 13.5 tt -96.97 132.87 40.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 CA-C-O 121.034 0.445 . . . . 0.0 110.464 177.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.9 t -156.75 -161.54 1.11 Allowed 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 -176.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 67.51 16.55 9.96 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.652 0.739 . . . . 0.0 110.924 175.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 79.69 4.05 89.23 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.51 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -66.11 -27.67 68.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.223 0.535 . . . . 0.0 110.245 -178.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 27.4 ttm180 -64.02 -41.95 97.27 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.023 176.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -69.69 -32.86 71.71 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.508 177.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -64.08 -43.33 95.75 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.997 0.427 . . . . 0.0 109.969 175.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.565 HD22 HD12 ' A' ' 32' ' ' LEU . 57.8 mt -64.3 -45.69 86.87 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.092 176.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -56.69 -45.33 81.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.417 178.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 48.8 m -63.19 -33.38 75.34 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.048 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 71.5 mtm -81.79 -10.44 59.34 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.434 -179.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 108.1 5.0 33.2 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.661 -0.78 . . . . 0.0 113.138 174.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.595 HD13 HD11 ' A' ' 69' ' ' LEU . 97.5 mt -94.0 91.0 6.66 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 177.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.8 pp -135.75 157.85 75.32 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.336 -174.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.541 ' HB3' ' HA2' ' A' ' 14' ' ' GLY . 32.3 Cg_endo -65.69 124.01 12.18 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.698 2.265 . . . . 0.0 111.627 177.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.56 -7.41 17.95 Favored Glycine 0 N--CA 1.444 -0.819 0 C-N-CA 120.818 -0.706 . . . . 0.0 111.843 -176.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -97.27 -172.52 2.44 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-O 120.985 0.422 . . . . 0.0 110.553 178.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.452 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -160.13 149.71 17.86 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.654 -176.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 58.8 mt -125.22 138.53 54.12 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.781 178.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 36.9 ttp180 -111.5 124.22 51.84 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 176.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.555 ' HA ' HG12 ' A' ' 52' ' ' VAL . 7.4 p -61.58 127.79 21.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-O 121.109 0.481 . . . . 0.0 112.11 -174.458 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 92.7 t -102.71 -50.9 9.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.917 171.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.402 ' HG3' ' HB2' ' A' ' 51' ' ' GLN . 5.9 ptm180 -170.67 161.05 7.37 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.122 0.487 . . . . 0.0 111.785 -178.696 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 82.5 mt -135.1 143.19 37.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 171.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.761 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -69.13 142.34 92.78 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 117.88 0.309 . . . . 0.0 110.841 179.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 22.7 Cg_exo -66.06 -8.92 21.52 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 123.184 2.589 . . . . 0.0 113.25 -177.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.419 HD13 ' HA ' ' A' ' 46' ' ' LEU . 4.0 mm? -65.86 -88.48 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.643 0.735 . . . . 0.0 110.443 176.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -123.95 -74.53 0.27 Allowed Glycine 0 CA--C 1.491 -1.444 0 N-CA-C 109.425 -1.47 . . . . 0.0 109.425 172.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.442 ' OD2' ' HB3' ' A' ' 63' ' ' ARG . 4.9 p-10 -178.44 124.41 0.26 Allowed Pre-proline 0 N--CA 1.44 -0.955 0 N-CA-C 113.995 1.109 . . . . 0.0 113.995 174.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.761 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 15.1 Cg_endo -105.45 157.82 0.16 Allowed 'Trans proline' 0 N--CA 1.437 -1.812 0 C-N-CA 125.005 3.803 . . . . 0.0 107.458 136.539 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.625 HG22 HG13 ' A' ' 52' ' ' VAL . 4.5 mp -119.8 104.88 16.29 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.706 0 C-N-CA 118.988 -1.085 . . . . 0.0 110.365 -175.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.434 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 26.1 mp0 -88.65 117.85 27.9 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.078 174.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.625 HG13 HG22 ' A' ' 50' ' ' ILE . 14.1 m -132.94 172.44 16.46 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.51 -178.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.572 ' HG2' ' H ' ' A' ' 55' ' ' ARG . 34.0 tt0 -117.58 130.83 56.64 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.004 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 17.8 p -92.53 17.89 9.41 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.088 -179.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.572 ' H ' ' HG2' ' A' ' 53' ' ' GLU . 0.0 OUTLIER 63.32 21.09 12.63 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.818 0.818 . . . . 0.0 109.005 -173.935 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -141.72 -62.37 0.46 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.993 -1.003 . . . . 0.0 108.512 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.7 t -142.92 174.72 10.42 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.679 178.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 17.8 m -82.49 143.45 31.11 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.99 0.424 . . . . 0.0 110.331 178.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.434 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 43.8 tp -134.14 144.62 48.65 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.572 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.539 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -133.07 139.72 47.3 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.74 -0.663 . . . . 0.0 109.574 177.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.0 pp -154.84 178.81 9.73 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -176.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 25.6 mmt85 -115.73 170.55 8.37 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 121.92 0.866 . . . . 0.0 112.206 -178.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.442 ' HB3' ' OD2' ' A' ' 48' ' ' ASP . 13.1 ptt-85 -62.14 -36.15 80.91 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 113.611 -1.631 . . . . 0.0 111.766 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.428 ' HE3' ' HB3' ' A' ' 64' ' ' LYS . 1.3 tmmt? -58.16 -45.85 86.74 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.923 0.392 . . . . 0.0 110.624 178.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -71.74 -37.75 70.52 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.324 0.583 . . . . 0.0 110.137 178.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 18.7 tp -64.12 -33.25 75.34 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.78 -179.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.27 -18.37 63.13 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.777 -178.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.438 ' HB3' HD12 ' A' ' 19' ' ' ILE . 91.2 mt -88.76 -7.49 56.14 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.757 0.313 . . . . 0.0 110.959 -179.701 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.595 HD11 HD13 ' A' ' 32' ' ' LEU . 94.7 mt -103.49 141.75 35.46 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.545 178.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 25.1 m -96.77 114.52 26.16 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 172.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.493 ' CD2' HG12 ' A' ' 12' ' ' ILE . 74.5 mt -121.79 134.98 54.91 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.047 -172.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.446 ' O ' ' HG2' ' A' ' 11' ' ' ARG . 17.1 m -127.61 128.48 23.94 Favored Pre-proline 0 C--N 1.319 -0.725 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 170.573 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.648 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 36.9 Cg_endo -65.63 163.4 30.36 Favored 'Trans proline' 0 C--O 1.234 0.29 0 C-N-CA 122.526 2.151 . . . . 0.0 113.545 -173.231 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.456 HD23 ' CZ ' ' A' ' 11' ' ' ARG . 95.7 mt -94.63 -71.77 0.65 Allowed 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.292 -0.867 . . . . 0.0 108.708 173.125 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 . . . . . 0 C--O 1.253 1.249 0 CA-C-O 117.748 -1.12 . . . . 0.0 109.304 175.603 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.8 mtm . . . . . 0 N--CA 1.481 1.087 0 CA-C-O 120.837 0.351 . . . . 0.0 110.775 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.9 p -144.28 104.59 4.12 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.589 175.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -80.76 76.73 7.65 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.239 -171.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -161.42 140.99 10.33 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.312 172.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -138.67 91.6 11.96 Favored Pre-proline 0 C--N 1.319 -0.747 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 176.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.561 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 19.1 Cg_exo -66.53 126.99 16.4 Favored 'Trans proline' 0 N--CA 1.461 -0.432 0 C-N-CA 122.956 2.437 . . . . 0.0 112.276 -177.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 23.4 t -79.43 -66.37 0.88 Allowed 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 176.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.407 ' H ' HG12 ' A' ' 40' ' ' VAL . 88.3 mtt180 -149.34 153.47 37.5 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 120.857 0.36 . . . . 0.0 110.775 177.02 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.514 ' HB2' HD12 ' A' ' 74' ' ' LEU . 2.2 m -95.79 135.56 37.35 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.921 179.414 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.542 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 44.8 m-85 -113.97 141.09 47.83 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.213 -177.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.53 ' HD2' HD23 ' A' ' 74' ' ' LEU . 45.4 mtp180 -97.96 144.94 26.98 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 178.652 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.439 HG12 ' CD2' ' A' ' 71' ' ' LEU . 18.7 mt -99.02 113.67 34.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 177.235 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 12.6 p -102.0 -3.63 27.4 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -175.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.491 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 160.46 -161.73 32.84 Favored Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 119.946 -1.121 . . . . 0.0 112.445 175.541 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -118.93 156.61 29.25 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 36.9 t -66.1 137.36 95.74 Favored Pre-proline 0 C--N 1.319 -0.726 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 170.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -59.22 -14.81 25.77 Favored 'Trans proline' 0 CA--C 1.529 0.272 0 C-N-CA 122.838 2.359 . . . . 0.0 112.867 -176.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -78.3 -8.59 58.57 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.746 -178.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 15.7 tt -63.16 129.12 26.29 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-O 121.163 0.506 . . . . 0.0 110.523 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.3 t -134.21 178.16 7.19 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.318 -172.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 58.58 -158.99 0.29 Allowed 'General case' 0 CA--C 1.534 0.352 0 O-C-N 123.651 0.594 . . . . 0.0 109.59 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -94.09 25.62 21.11 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.817 -0.706 . . . . 0.0 111.782 176.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.447 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 4.9 t80 -64.48 -32.3 73.87 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.024 0.44 . . . . 0.0 110.154 -177.483 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 14.4 ttm180 -58.9 -42.11 88.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.464 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -65.61 -39.73 91.85 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.409 -179.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 34.1 ttt180 -66.17 -39.49 89.79 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.972 178.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 23' ' ' TYR . 85.2 mt -66.83 -44.3 81.44 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.349 179.298 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -57.62 -44.75 85.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.115 177.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 47.2 m -63.21 -34.17 77.06 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.172 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.525 ' HA ' ' CE ' ' A' ' 30' ' ' MET . 15.9 mmt -74.34 -24.67 59.22 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.848 -179.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.06 6.04 14.35 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.498 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.677 HD13 HD11 ' A' ' 69' ' ' LEU . 68.7 mt -97.66 90.86 5.15 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.2 pp -141.29 155.15 67.95 Favored Pre-proline 0 C--N 1.322 -0.604 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.065 -174.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.491 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 24.0 Cg_exo -63.72 127.05 18.71 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.815 2.343 . . . . 0.0 111.931 178.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.64 5.67 44.86 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.081 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -107.52 -179.45 3.92 Favored 'General case' 0 N--CA 1.442 -0.853 0 CA-C-O 120.968 0.413 . . . . 0.0 109.957 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -148.55 145.59 27.92 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.093 -177.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.471 HD13 HG21 ' A' ' 52' ' ' VAL . 45.6 mt -129.39 131.12 46.74 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.45 177.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.476 ' HA ' ' HA ' ' A' ' 9' ' ' SER . 38.3 ttm180 -100.61 118.84 37.58 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.222 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.634 ' HA ' HG12 ' A' ' 52' ' ' VAL . 7.5 p -65.32 131.09 31.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.56 0.695 . . . . 0.0 111.506 -174.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.754 HG12 ' HG3' ' A' ' 42' ' ' ARG . 59.2 t -95.84 -54.97 6.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.942 174.111 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.754 ' HG3' HG12 ' A' ' 41' ' ' VAL . 54.9 mtp180 -155.23 143.49 20.24 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -176.168 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.432 HG23 ' HD2' ' A' ' 49' ' ' PRO . 4.7 mp -114.87 119.43 61.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 161.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.417 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -56.91 127.87 75.77 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-O 120.525 0.202 . . . . 0.0 111.129 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 38.4 Cg_exo -62.33 -8.56 12.83 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 123.415 2.743 . . . . 0.0 112.61 -179.18 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -56.24 -38.36 70.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.554 173.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 170.52 -77.01 0.1 OUTLIER Glycine 0 N--CA 1.438 -1.172 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 -176.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -169.85 120.74 0.58 Allowed Pre-proline 0 N--CA 1.452 -0.361 0 CA-C-O 122.257 1.027 . . . . 0.0 113.666 177.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.432 ' HD2' HG23 ' A' ' 43' ' ' ILE . 89.7 Cg_endo -117.96 -166.79 0.01 OUTLIER 'Trans proline' 0 N--CA 1.438 -1.786 1 C-N-CA 126.337 4.691 . . . . 0.0 107.777 139.206 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.741 HG22 HG13 ' A' ' 52' ' ' VAL . 54.5 mt -143.8 101.9 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.239 0 C-N-CA 120.255 -0.578 . . . . 0.0 109.628 168.124 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.514 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 54.2 mt-30 -87.91 119.09 27.93 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 175.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.741 HG13 HG22 ' A' ' 50' ' ' ILE . 17.7 m -132.68 171.88 17.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 120.802 0.335 . . . . 0.0 111.56 -175.379 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.498 ' HG3' ' H ' ' A' ' 55' ' ' ARG . 10.1 tp10 -138.82 141.19 38.71 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 176.201 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.1 t -124.13 18.53 9.16 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.639 0.733 . . . . 0.0 109.644 -176.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.498 ' H ' ' HG3' ' A' ' 53' ' ' GLU . 74.6 mtm180 74.52 23.7 1.87 Allowed 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.66 178.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -140.91 -52.92 0.47 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.275 0.56 . . . . 0.0 110.062 -178.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 59.9 m -153.84 135.67 14.54 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.472 -0.785 . . . . 0.0 109.428 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.5 m -76.65 131.52 38.89 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 175.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.514 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 3.0 mm? -121.64 171.75 8.61 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.98 0.419 . . . . 0.0 111.495 -176.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.539 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -146.25 141.79 27.72 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 174.172 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.458 ' C ' ' HD2' ' A' ' 62' ' ' ARG . 4.1 pp -146.18 155.45 42.72 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 120.693 -0.403 . . . . 0.0 110.167 -173.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.603 ' N ' ' HD2' ' A' ' 62' ' ' ARG . 4.2 mpt_? -104.39 164.79 11.49 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.585 -178.085 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.403 ' HA ' ' HB3' ' A' ' 66' ' ' LEU . 45.5 mtm180 -50.76 -36.05 34.8 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 114.858 -1.065 . . . . 0.0 112.925 -178.553 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -59.19 -49.33 78.26 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.761 0.315 . . . . 0.0 110.824 178.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -72.39 -34.37 67.88 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.035 0.445 . . . . 0.0 110.194 178.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.408 HD13 HD12 ' A' ' 50' ' ' ILE . 62.6 tp -62.71 -37.05 84.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.005 178.213 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.71 -18.56 65.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.731 -178.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 96.0 mt -94.77 -4.59 47.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.566 -178.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.677 HD11 HD13 ' A' ' 32' ' ' LEU . 92.1 mt -111.5 129.24 56.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.778 0.323 . . . . 0.0 111.521 -176.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.9 m -88.55 115.95 26.44 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 172.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.439 ' CD2' HG12 ' A' ' 12' ' ' ILE . 70.5 mt -124.93 135.33 52.74 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.021 -174.489 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 24.1 m -133.76 132.64 21.7 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.455 173.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.542 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 17.1 Cg_exo -66.07 164.05 29.06 Favored 'Trans proline' 0 CA--C 1.533 0.427 0 C-N-CA 122.48 2.12 . . . . 0.0 113.196 -175.398 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.53 HD23 ' HD2' ' A' ' 11' ' ' ARG . 39.2 mt -67.69 -26.32 66.12 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.207 175.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 37.1 t70 . . . . . 0 C--O 1.248 1.001 0 O-C-N 124.102 0.876 . . . . 0.0 110.707 -178.186 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 49.2 ttm . . . . . 0 N--CA 1.478 0.937 0 CA-C-O 121.161 0.505 . . . . 0.0 109.991 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.5 m -127.34 119.21 25.71 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.437 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -86.31 111.74 20.75 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.958 0.409 . . . . 0.0 111.345 -177.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.791 HD22 ' HG2' ' A' ' 42' ' ' ARG . 9.9 mp -88.54 137.86 31.94 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 175.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.449 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 73.4 mt-30 -82.86 128.35 66.14 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.675 -176.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.449 ' HB3' ' HG2' ' A' ' 39' ' ' ARG . 31.5 Cg_exo -61.17 123.98 13.93 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 122.826 2.351 . . . . 0.0 111.788 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.2 t -104.18 -77.04 0.58 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.825 -173.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -95.93 169.95 9.63 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.441 0.639 . . . . 0.0 111.78 -175.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.573 ' HB3' HD12 ' A' ' 74' ' ' LEU . 23.4 t -140.29 140.28 35.66 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 114.994 -1.003 . . . . 0.0 109.483 176.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.585 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 15.0 m-85 -121.14 128.33 52.43 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 -178.17 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.467 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 67.6 mtp180 -97.81 149.87 21.88 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.515 178.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 25.5 mt -88.08 117.2 31.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 8.8 t -94.8 -18.47 21.2 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.944 0.402 . . . . 0.0 110.271 -179.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 166.89 -161.66 35.46 Favored Glycine 0 N--CA 1.443 -0.849 0 C-N-CA 120.449 -0.881 . . . . 0.0 112.269 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -105.81 158.35 16.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.677 0.275 . . . . 0.0 110.446 -178.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.459 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 31.3 t -52.05 134.24 39.69 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.945 175.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 17.7 Cg_exo -67.77 2.53 2.44 Favored 'Trans proline' 0 C--O 1.235 0.374 0 C-N-CA 122.954 2.436 . . . . 0.0 112.649 178.5 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -115.52 6.7 14.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.916 178.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.457 HG22 ' O ' ' A' ' 16' ' ' SER . 10.8 tt -87.9 150.48 3.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.908 0.385 . . . . 0.0 110.812 -177.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 35.4 t -89.67 158.69 17.47 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.156 178.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.459 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 15.0 m120 -54.95 -44.3 74.2 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.237 -179.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.1 -36.67 92.22 Favored Glycine 0 C--N 1.329 0.173 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.833 -176.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -72.71 -31.19 64.82 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.435 ' HB3' ' O ' ' A' ' 21' ' ' ASN . 12.8 ttt180 -62.0 -43.79 98.1 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.746 172.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.459 ' HG3' ' O ' ' A' ' 21' ' ' ASN . 28.1 mt-30 -61.1 -41.88 97.48 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.565 177.182 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -57.83 -48.53 79.51 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.326 175.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.53 HD22 HD12 ' A' ' 32' ' ' LEU . 41.2 mt -67.55 -40.15 84.99 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.682 -176.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -60.34 -46.14 90.95 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.026 178.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 46.1 m -65.99 -31.49 72.42 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.141 179.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 82.5 mtp -71.03 -24.52 62.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.536 177.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 112.39 6.54 23.62 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.89 -0.671 . . . . 0.0 112.184 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.573 HD13 HD11 ' A' ' 69' ' ' LEU . 85.8 mt -98.31 97.3 8.69 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.989 0.423 . . . . 0.0 110.051 -178.272 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.4 pp -142.06 157.6 63.5 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.871 -176.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.66 139.38 88.59 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.731 2.287 . . . . 0.0 112.357 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 112.07 -21.07 20.87 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.328 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -85.53 -177.51 6.45 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 121.048 0.452 . . . . 0.0 110.35 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.467 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -159.65 134.93 8.22 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.91 -176.369 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.462 ' N ' HD22 ' A' ' 38' ' ' LEU . 2.2 mm? -108.55 141.18 40.85 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.622 176.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.449 ' HG2' ' HB3' ' A' ' 6' ' ' PRO . 20.5 ttm180 -109.09 127.72 54.38 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 176.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.572 ' HA ' HG12 ' A' ' 52' ' ' VAL . 9.9 p -67.27 127.71 29.29 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-O 121.309 0.576 . . . . 0.0 111.662 -172.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.8 t -106.73 -50.68 7.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.703 173.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.791 ' HG2' HD22 ' A' ' 4' ' ' LEU . 1.1 mtp180 -156.92 159.66 38.34 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -174.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.419 HG23 ' HD2' ' A' ' 49' ' ' PRO . 80.0 mt -127.45 142.53 43.33 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 162.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.646 ' H ' ' CD ' ' A' ' 49' ' ' PRO . . . -84.14 140.27 39.65 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-O 120.554 0.216 . . . . 0.0 111.523 -177.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -65.8 -7.39 16.5 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 123.107 2.538 . . . . 0.0 112.152 176.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.598 HD13 ' HB1' ' A' ' 44' ' ' ALA . 10.0 mp -57.76 -28.82 64.29 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.752 0.787 . . . . 0.0 110.336 173.36 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 153.95 -76.97 0.21 Allowed Glycine 0 N--CA 1.432 -1.633 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 -175.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -170.92 124.2 0.59 Allowed Pre-proline 0 N--CA 1.435 -1.195 0 CA-C-O 122.321 1.057 . . . . 0.0 113.094 174.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.646 ' CD ' ' H ' ' A' ' 44' ' ' ALA . 97.9 Cg_endo -115.04 -162.16 0.02 OUTLIER 'Trans proline' 0 N--CA 1.432 -2.146 1 C-N-CA 125.749 4.299 . . . . 0.0 107.686 143.3 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.791 HG22 HG13 ' A' ' 52' ' ' VAL . 52.5 mt -141.83 102.63 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.282 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 166.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -79.23 118.73 21.43 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 177.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.791 HG13 HG22 ' A' ' 50' ' ' ILE . 17.3 m -136.87 173.7 13.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-O 120.808 0.337 . . . . 0.0 111.313 -176.184 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -124.66 142.99 50.98 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 176.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 8.6 m -110.31 -39.25 5.02 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.683 -177.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 16.0 ptt180 179.46 -45.38 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.099 -0.5 . . . . 0.0 112.031 -177.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -132.27 -14.1 3.01 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -171.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.8 t -156.19 129.95 8.43 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.078 0.466 . . . . 0.0 110.279 -175.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.8 m -76.68 138.14 39.83 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.64 -177.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 16.6 mt -126.89 174.56 8.72 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.222 -175.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.457 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -134.78 161.24 35.73 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.35 178.392 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.786 HD11 HD12 ' A' ' 50' ' ' ILE . 4.2 pp -151.43 158.68 44.0 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 179.127 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.648 ' N ' ' HD2' ' A' ' 62' ' ' ARG . 6.3 mpt_? -109.32 176.35 5.12 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 -175.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -61.73 -38.27 87.28 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.032 178.359 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.449 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 55.0 tptt -64.53 -49.3 71.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.278 176.322 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -61.88 -39.33 91.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.587 179.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 55.6 tp -63.33 -37.82 88.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.817 178.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.66 -10.9 60.48 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.557 -178.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 64' ' ' LYS . 77.3 mt -87.07 -23.41 24.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.739 0.304 . . . . 0.0 111.05 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.573 HD11 HD13 ' A' ' 32' ' ' LEU . 95.7 mt -113.97 135.38 54.06 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.584 -178.64 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.9 m -90.4 115.85 27.89 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 174.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 80.2 mt -110.85 133.48 53.33 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.951 -175.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.3 m -114.55 114.87 44.71 Favored Pre-proline 0 C--N 1.319 -0.728 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.369 172.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.585 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 39.6 Cg_endo -68.31 163.0 38.05 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 121.988 1.792 . . . . 0.0 112.087 -177.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.573 HD12 ' HB3' ' A' ' 9' ' ' SER . 80.0 mt -76.28 1.76 15.17 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.412 175.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 32.5 t70 . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.408 -0.806 . . . . 0.0 109.808 178.131 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.2 mpt? . . . . . 0 N--CA 1.483 1.189 0 CA-C-O 120.455 0.169 . . . . 0.0 110.82 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.2 m 67.01 34.06 5.37 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.627 0.727 . . . . 0.0 109.542 -171.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -121.17 125.77 48.01 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.349 -0.842 . . . . 0.0 110.54 -178.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.649 ' HA ' ' HD2' ' A' ' 42' ' ' ARG . 1.2 pp -150.46 -178.84 6.77 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.359 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.474 ' O ' ' HA ' ' A' ' 42' ' ' ARG . 36.3 tt0 -151.1 84.5 5.3 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-O 120.857 0.36 . . . . 0.0 110.131 -178.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.422 ' HD3' HD13 ' A' ' 4' ' ' LEU . 92.2 Cg_endo -90.52 171.88 3.47 Favored 'Trans proline' 0 N--CA 1.452 -0.93 0 C-N-CA 122.951 2.434 . . . . 0.0 112.212 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 18.9 t -156.5 -85.39 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.58 177.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.408 ' O ' HG12 ' A' ' 40' ' ' VAL . 86.8 mtt-85 -143.99 -174.91 4.4 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 121.108 0.48 . . . . 0.0 111.178 -172.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.466 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 17.8 m -101.44 144.97 29.58 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.083 -178.194 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.766 ' HE2' ' HB ' ' A' ' 40' ' ' VAL . 39.1 m-85 -121.61 128.13 51.61 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 177.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.493 ' HG2' ' HB2' ' A' ' 37' ' ' ALA . 98.3 mtt180 -90.25 155.81 18.74 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.569 -0.452 . . . . 0.0 110.584 178.349 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.7 mt -105.77 111.47 35.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.829 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 3.0 p -81.14 -21.3 39.91 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.896 0.379 . . . . 0.0 110.822 179.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.54 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 159.51 -144.49 10.23 Favored Glycine 0 N--CA 1.439 -1.11 0 C-N-CA 120.109 -1.044 . . . . 0.0 112.134 177.331 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.474 ' CB ' HG21 ' A' ' 19' ' ' ILE . 21.3 m-85 -123.96 157.82 33.47 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -177.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.487 ' O ' HG22 ' A' ' 19' ' ' ILE . 20.4 m -59.49 134.98 88.86 Favored Pre-proline 0 N--CA 1.447 -0.592 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 172.202 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 85.6 Cg_exo -48.05 -29.78 12.87 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 123.723 2.949 . . . . 0.0 114.736 -173.149 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -88.18 10.51 19.18 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -174.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.487 HG22 ' O ' ' A' ' 16' ' ' SER . 17.2 tt -77.71 114.74 18.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.492 0.663 . . . . 0.0 109.991 176.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.53 ' O ' ' HB2' ' A' ' 21' ' ' ASN . 65.4 m -165.83 99.17 0.66 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.825 -172.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.53 ' HB2' ' O ' ' A' ' 20' ' ' SER . 3.7 t30 171.37 33.27 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 177.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 73.47 -1.15 45.2 Favored Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.149 -173.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -60.55 -32.26 71.34 Favored 'General case' 0 C--N 1.334 -0.075 0 CA-C-O 120.774 0.321 . . . . 0.0 111.066 -175.578 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 11.8 mtp180 -62.27 -41.87 98.84 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.723 176.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -67.76 -34.69 77.31 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 120.963 0.411 . . . . 0.0 110.301 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.462 ' HA ' ' HD2' ' A' ' 26' ' ' ARG . 16.5 tpt180 -64.26 -42.91 96.25 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.771 -0.65 . . . . 0.0 109.978 176.028 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.637 HD13 HD21 ' A' ' 69' ' ' LEU . 90.6 mt -70.36 -38.08 74.71 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.504 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -59.53 -40.51 87.41 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.792 175.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 50.3 m -67.85 -33.23 74.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.838 179.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.544 ' HA ' ' CE ' ' A' ' 30' ' ' MET . 10.6 mmt -73.7 -23.17 59.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.868 178.39 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 109.28 12.67 19.29 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.894 -0.669 . . . . 0.0 112.343 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.4 mt -101.32 95.51 6.56 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.888 0.375 . . . . 0.0 110.325 -179.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.405 ' H ' HD23 ' A' ' 33' ' ' LEU . 1.9 pt? -130.88 154.74 82.02 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.288 -177.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.54 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 27.9 Cg_exo -61.48 119.49 6.66 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.722 2.281 . . . . 0.0 111.713 178.041 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.75 -7.12 17.68 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.773 -0.727 . . . . 0.0 111.996 -177.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -94.33 -171.96 2.66 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 120.984 0.421 . . . . 0.0 110.192 178.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.493 ' HB2' ' HG2' ' A' ' 11' ' ' ARG . . . -155.22 148.13 24.51 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.714 -177.014 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.571 HD13 HG21 ' A' ' 52' ' ' VAL . 33.0 mt -125.52 132.63 52.58 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 178.595 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 42.9 ttp180 -98.27 124.23 42.78 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 178.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.766 ' HB ' ' HE2' ' A' ' 10' ' ' TYR . 8.1 p -69.1 126.09 28.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.344 0.592 . . . . 0.0 111.416 -174.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 65.2 t -97.44 -44.58 12.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.353 177.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.649 ' HD2' ' HA ' ' A' ' 4' ' ' LEU . 78.8 ttt180 -165.41 135.55 3.64 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.868 0.366 . . . . 0.0 111.551 176.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.7 mp -90.77 129.33 41.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 172.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.436 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -64.62 131.45 95.12 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-O 120.656 0.265 . . . . 0.0 110.385 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 44.5 Cg_exo -58.31 -18.6 38.77 Favored 'Trans proline' 0 CA--C 1.532 0.404 0 C-N-CA 123.236 2.624 . . . . 0.0 113.093 -177.258 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -88.42 -20.46 25.22 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.334 -177.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 101.29 -13.56 58.48 Favored Glycine 0 C--O 1.235 0.177 0 N-CA-C 111.212 -0.755 . . . . 0.0 111.212 -173.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.583 ' CB ' ' HD2' ' A' ' 49' ' ' PRO . 0.5 OUTLIER -62.72 169.21 3.48 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 114.986 -0.607 . . . . 0.0 110.522 172.706 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.583 ' HD2' ' CB ' ' A' ' 48' ' ' ASP . 12.0 Cg_exo -29.07 151.68 0.01 OUTLIER 'Trans proline' 0 C--N 1.361 1.217 1 C-N-CA 125.335 4.024 . . . . 0.0 116.059 -170.786 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.504 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 60.0 mt -110.83 133.72 55.41 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 113.87 -1.514 . . . . 0.0 109.734 -173.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 -84.83 118.87 24.74 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.304 -179.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.571 HG21 HD13 ' A' ' 38' ' ' LEU . 27.6 m -128.92 167.12 24.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.1 178.337 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -129.29 151.0 50.42 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 -177.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 18.4 p -119.46 -64.28 1.29 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.627 -179.139 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.426 HH11 ' HD3' ' A' ' 55' ' ' ARG . 38.7 ttp180 -168.62 18.45 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.57 -176.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -148.29 -51.28 0.17 Allowed 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -172.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.4 t -173.02 167.2 5.01 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 -175.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.424 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 1.8 p -81.76 126.35 31.72 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.293 0.568 . . . . 0.0 111.417 -176.425 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 53.0 tp -118.87 147.22 44.2 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.79 -178.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.566 ' HB1' ' HB2' ' A' ' 49' ' ' PRO . . . -110.93 127.14 55.38 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.752 0.311 . . . . 0.0 110.602 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.7 pp -103.59 132.78 49.55 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.709 ' HD3' ' OD2' ' A' ' 65' ' ' ASP . 0.5 OUTLIER -75.49 174.45 9.63 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.069 0.461 . . . . 0.0 111.136 -170.715 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 23.0 mmm180 -62.19 -33.55 74.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.177 174.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -62.14 -52.75 62.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.841 177.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.709 ' OD2' ' HD3' ' A' ' 62' ' ' ARG . 33.4 m-20 -63.01 -41.99 99.7 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.087 -179.198 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 54.1 tp -60.18 -38.49 83.39 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.799 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.31 -15.76 62.42 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.953 0.406 . . . . 0.0 111.404 -179.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 94.4 mt -108.25 -4.32 17.65 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.383 -179.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.637 HD21 HD13 ' A' ' 27' ' ' LEU . 82.7 mt -110.67 134.82 52.11 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.778 0.323 . . . . 0.0 110.95 -179.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 32.2 m -106.58 116.9 32.73 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.213 0.53 . . . . 0.0 110.287 174.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.8 mp -124.62 150.49 45.96 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.696 -177.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 16.9 m -130.33 123.21 20.42 Favored Pre-proline 0 C--N 1.319 -0.731 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 175.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.46 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 36.2 Cg_endo -66.48 164.15 29.74 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.031 1.821 . . . . 0.0 111.601 179.032 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 9' ' ' SER . 91.1 mt -54.59 -40.88 69.27 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.796 172.35 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 22.8 t70 . . . . . 0 C--O 1.248 0.984 0 O-C-N 124.065 0.853 . . . . 0.0 110.843 173.864 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.067 0 CA-C-O 120.906 0.384 . . . . 0.0 110.65 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.4 m -82.79 76.74 9.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.098 0.475 . . . . 0.0 111.603 -177.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.665 ' HB3' HH21 ' A' ' 42' ' ' ARG . . . -102.13 82.46 2.22 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.426 0.631 . . . . 0.0 109.365 174.228 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 64.0 tp -103.01 118.35 36.61 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.304 -173.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -144.57 94.06 5.64 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.781 173.058 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.401 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 15.3 Cg_exo -68.65 133.42 27.62 Favored 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 122.647 2.231 . . . . 0.0 111.521 178.552 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.42 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 22.7 t -93.32 -82.9 0.33 Allowed 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.915 -0.314 . . . . 0.0 110.159 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 53.2 mtt180 -129.52 -176.29 3.85 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 121.033 0.444 . . . . 0.0 110.733 -179.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.425 ' HB2' HD12 ' A' ' 74' ' ' LEU . 16.1 m -124.11 138.77 54.39 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.58 -178.565 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.439 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 52.3 m-85 -122.24 133.05 54.71 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.584 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 8.0 ptp180 -100.5 157.62 16.51 Favored 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 119.998 -0.681 . . . . 0.0 110.261 175.551 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.433 HG12 ' CD2' ' A' ' 71' ' ' LEU . 22.2 mt -100.64 116.35 43.94 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.944 -179.784 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 1.4 m -92.22 -19.75 21.89 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.882 -177.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 164.79 -149.41 16.12 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.424 -179.28 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.459 ' HB3' HG21 ' A' ' 19' ' ' ILE . 72.5 m-85 -121.97 152.63 39.5 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.828 0.347 . . . . 0.0 110.821 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.737 ' O ' HG22 ' A' ' 19' ' ' ILE . 49.4 m -82.24 153.25 68.85 Favored Pre-proline 0 N--CA 1.448 -0.542 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.887 -179.53 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -62.38 -16.26 50.48 Favored 'Trans proline' 0 CA--C 1.532 0.395 0 C-N-CA 122.693 2.262 . . . . 0.0 113.218 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -83.92 -7.18 59.49 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -177.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.737 HG22 ' O ' ' A' ' 16' ' ' SER . 10.4 tt -92.88 147.7 5.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 C-N-CA 120.556 -0.458 . . . . 0.0 110.719 -179.409 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.3 t -84.98 158.1 20.6 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.635 -0.505 . . . . 0.0 109.635 178.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.493 ' O ' ' HB3' ' A' ' 24' ' ' ARG . 26.8 t-20 -63.5 -47.48 81.54 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.649 0.261 . . . . 0.0 111.373 -174.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.73 -38.33 95.48 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.433 -0.889 . . . . 0.0 112.208 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -64.53 -39.89 94.6 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 177.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.493 ' HB3' ' O ' ' A' ' 21' ' ' ASN . 15.9 ttm180 -56.2 -45.22 79.92 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.376 172.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -68.91 -31.57 70.58 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.224 -178.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.466 ' O ' ' HG3' ' A' ' 30' ' ' MET . 4.0 tmm_? -68.71 -39.68 80.32 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 175.509 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.452 HD22 HD12 ' A' ' 32' ' ' LEU . 40.2 mt -68.18 -40.5 82.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.332 0.587 . . . . 0.0 110.317 176.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -55.57 -48.02 75.47 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.079 174.255 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 47.8 m -60.07 -33.89 72.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.15 178.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.466 ' HG3' ' O ' ' A' ' 26' ' ' ARG . 90.1 mtp -70.47 -27.33 64.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.898 178.649 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.77 8.07 11.22 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.356 -178.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.472 HD13 HD11 ' A' ' 69' ' ' LEU . 76.4 mt -99.69 94.03 6.14 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.009 0.433 . . . . 0.0 110.09 -179.388 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.515 ' HB2' ' HD2' ' A' ' 34' ' ' PRO . 1.7 pt? -140.31 161.83 53.03 Favored Pre-proline 0 N--CA 1.447 -0.596 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.496 -178.588 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.515 ' HD2' ' HB2' ' A' ' 33' ' ' LEU . 18.7 Cg_endo -59.74 128.46 27.01 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.867 2.378 . . . . 0.0 111.77 175.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 111.62 4.05 26.76 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.128 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -113.82 172.83 6.75 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 120.982 0.42 . . . . 0.0 110.132 178.201 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.584 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -152.89 139.66 18.95 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.412 -178.05 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.668 HD13 HG21 ' A' ' 52' ' ' VAL . 50.5 mt -127.16 136.72 52.47 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.193 -178.113 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 16.3 ttm180 -99.67 131.06 45.9 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 174.028 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.597 HG21 HD11 ' A' ' 43' ' ' ILE . 9.0 p -72.55 135.08 28.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.342 0.591 . . . . 0.0 111.695 -172.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 75.4 t -106.54 -47.34 8.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.643 176.331 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.665 HH21 ' HB3' ' A' ' 3' ' ' ALA . 79.0 mtt180 -157.64 138.91 13.57 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -172.533 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.597 HD11 HG21 ' A' ' 40' ' ' VAL . 4.5 mp -130.0 119.87 48.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 163.39 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.718 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -67.62 138.19 93.41 Favored Pre-proline 0 C--N 1.322 -0.607 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.125 -176.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -58.88 -19.17 45.99 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 123.618 2.879 . . . . 0.0 112.924 -178.463 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -55.96 -39.62 72.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.723 0.773 . . . . 0.0 110.727 176.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 162.16 -74.52 0.19 Allowed Glycine 0 CA--C 1.494 -1.23 0 N-CA-C 110.509 -1.036 . . . . 0.0 110.509 -175.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.635 ' OD1' HG13 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -163.23 120.72 1.23 Allowed Pre-proline 0 N--CA 1.436 -1.132 0 N-CA-C 115.543 1.683 . . . . 0.0 115.543 176.897 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.718 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 31.3 Cg_endo -116.33 155.08 0.03 OUTLIER 'Trans proline' 0 N--CA 1.437 -1.798 1 C-N-CA 125.348 4.032 . . . . 0.0 108.439 123.614 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.94 HD13 HD22 ' A' ' 66' ' ' LEU . 96.0 mt -118.45 103.81 15.18 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.721 0 C-N-CA 119.209 -0.997 . . . . 0.0 110.938 -177.535 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.706 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 36.0 mt-30 -92.9 123.31 36.07 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.979 177.199 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.668 HG21 HD13 ' A' ' 38' ' ' LEU . 27.1 m -139.68 170.3 15.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.164 -177.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -116.9 135.48 53.69 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.1 m -110.29 -41.24 4.45 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.673 -172.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.7 ttm180 -176.72 -37.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.747 -173.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -120.93 -53.44 2.06 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.879 0.371 . . . . 0.0 110.638 -174.464 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.6 t -142.31 175.07 10.05 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 -174.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.497 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 13.9 m -88.53 134.05 33.98 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-O 121.318 0.58 . . . . 0.0 110.624 -178.725 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.706 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 3.1 mm? -112.02 173.72 6.22 Favored 'General case' 0 C--N 1.317 -0.848 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.178 179.486 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.595 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -142.19 144.4 33.39 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.088 -178.416 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -154.36 -175.34 5.35 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 -178.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.415 ' HA ' ' HD3' ' A' ' 62' ' ' ARG . 19.6 mmt180 -107.42 160.27 15.76 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 122.208 1.004 . . . . 0.0 112.792 -178.445 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -56.0 -41.44 74.87 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 113.008 -1.905 . . . . 0.0 112.094 -179.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.552 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 42.8 tttp -66.97 -43.11 83.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.714 0.292 . . . . 0.0 110.489 -176.152 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -59.71 -40.68 88.75 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.145 177.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.94 HD22 HD13 ' A' ' 50' ' ' ILE . 10.4 tp -70.48 -39.02 74.48 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.632 179.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.74 -26.84 66.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.456 -179.208 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.632 ' HB3' ' HB ' ' A' ' 19' ' ' ILE . 94.6 mt -77.51 -7.65 56.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.983 0.421 . . . . 0.0 110.564 177.564 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.472 HD11 HD13 ' A' ' 32' ' ' LEU . 68.5 mt -99.02 140.91 32.47 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.662 174.342 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 28.7 m -85.74 114.05 22.4 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 172.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.567 HD11 ' HG ' ' A' ' 66' ' ' LEU . 68.9 mt -120.3 139.12 53.2 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.626 -174.332 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.418 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 28.5 m -127.0 129.52 23.97 Favored Pre-proline 0 C--N 1.318 -0.799 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.496 170.054 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.439 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 3.3 Cg_exo -75.65 162.43 35.46 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 122.108 1.872 . . . . 0.0 111.736 -179.289 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.425 HD12 ' HB2' ' A' ' 9' ' ' SER . 60.7 mt -69.78 -34.62 74.01 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.204 172.55 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 37.1 t70 . . . . . 0 C--O 1.25 1.121 0 CA-C-O 118.611 -0.709 . . . . 0.0 109.834 177.906 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.1 mtt . . . . . 0 N--CA 1.482 1.134 0 CA-C-O 120.611 0.243 . . . . 0.0 110.535 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.1 m -76.15 91.24 3.14 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.042 0.449 . . . . 0.0 111.633 -177.28 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -112.78 39.09 2.6 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.638 0.732 . . . . 0.0 109.173 173.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.559 HD22 HG12 ' A' ' 41' ' ' VAL . 61.1 mt -102.29 141.33 35.29 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.113 -173.356 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -155.19 93.96 2.66 Favored Pre-proline 0 C--N 1.325 -0.479 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.116 175.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.604 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 25.4 Cg_exo -63.36 139.3 70.57 Favored 'Trans proline' 0 N--CA 1.464 -0.231 0 C-N-CA 123.056 2.504 . . . . 0.0 112.43 -179.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 48.0 t -126.9 -80.07 0.6 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.104 -179.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.408 ' H ' HG12 ' A' ' 40' ' ' VAL . 42.2 mtp85 -115.45 152.85 32.17 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.12 0.486 . . . . 0.0 111.475 -175.469 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.472 ' HB2' HD11 ' A' ' 74' ' ' LEU . 7.8 m -117.12 143.87 45.32 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.062 177.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 93.9 m-85 -128.89 140.03 51.87 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.813 0.339 . . . . 0.0 110.863 -175.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.61 ' HD3' ' HB2' ' A' ' 37' ' ' ALA . 28.7 mmt180 -83.75 150.91 25.51 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.829 175.21 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.597 HG12 ' CD2' ' A' ' 71' ' ' LEU . 46.0 mt -103.06 113.07 38.76 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 169.425 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 6.7 p -90.32 -11.68 40.01 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.06 0.457 . . . . 0.0 111.092 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 161.2 -158.33 30.0 Favored Glycine 0 N--CA 1.442 -0.955 0 C-N-CA 120.293 -0.956 . . . . 0.0 112.175 177.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 48.2 m-85 -114.99 150.17 36.23 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 -179.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.419 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 53.0 m -72.22 137.89 81.56 Favored Pre-proline 0 C--N 1.316 -0.884 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.424 -179.416 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 62.9 Cg_exo -52.88 156.3 9.63 Favored 'Trans proline' 0 C--O 1.237 0.474 0 C-N-CA 122.941 2.427 . . . . 0.0 112.548 178.396 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 17' ' ' PRO . . . 75.01 12.9 3.39 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.289 -177.143 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 16.0 tt -83.94 146.71 6.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.192 176.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.9 t -74.44 140.31 44.56 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 178.497 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -62.06 -49.83 74.4 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.917 -177.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.45 -31.27 80.32 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.976 -0.631 . . . . 0.0 112.359 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.446 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 21.5 t80 -72.59 -37.46 68.14 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.433 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.8 ttm180 -59.14 -43.0 91.99 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.759 172.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -66.04 -39.18 89.94 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.386 177.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.434 HH11 ' HD3' ' A' ' 26' ' ' ARG . 5.1 tpt180 -63.44 -39.31 94.14 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.019 178.268 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 23' ' ' TYR . 95.5 mt -66.58 -45.01 80.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.805 177.411 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -55.89 -47.77 76.82 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.3 176.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 50.3 m -60.93 -35.31 76.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.135 179.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 71.9 mtm -78.96 -14.98 58.89 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.75 -178.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 114.28 6.21 20.41 Favored Glycine 0 N--CA 1.453 -0.209 0 C-N-CA 120.331 -0.938 . . . . 0.0 113.026 175.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.665 HD13 HD11 ' A' ' 69' ' ' LEU . 82.6 mt -99.87 87.04 3.41 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 178.634 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.416 ' HB2' ' HD2' ' A' ' 34' ' ' PRO . 1.8 pt? -129.99 157.64 76.33 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.757 -177.186 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.416 ' HD2' ' HB2' ' A' ' 33' ' ' LEU . 18.0 Cg_endo -61.06 123.75 13.51 Favored 'Trans proline' 0 C--O 1.235 0.341 0 C-N-CA 122.534 2.156 . . . . 0.0 111.577 177.05 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 111.9 -17.43 24.98 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 121.04 -0.6 . . . . 0.0 111.856 -176.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -91.84 111.44 22.97 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.068 0.461 . . . . 0.0 110.234 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.61 ' HB2' ' HD3' ' A' ' 11' ' ' ARG . . . -90.37 129.06 36.62 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.828 177.353 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.417 ' N ' HD22 ' A' ' 38' ' ' LEU . 2.8 mm? -104.31 143.54 32.84 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.561 178.367 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 39' ' ' ARG . 36.1 ttm180 -105.21 124.62 49.85 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.339 176.482 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.604 ' O ' ' HA ' ' A' ' 6' ' ' PRO . 5.8 p -66.87 125.88 25.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.18 0.515 . . . . 0.0 110.377 -178.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.559 HG12 HD22 ' A' ' 4' ' ' LEU . 21.2 t -104.97 -39.46 5.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.543 -178.475 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 19.6 ttm180 -158.1 121.71 4.01 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 121.095 -0.242 . . . . 0.0 110.887 179.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.489 ' HA ' HG23 ' A' ' 50' ' ' ILE . 4.2 mp -97.42 130.37 46.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 178.514 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.461 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -75.58 134.69 72.5 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 174.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 24.7 Cg_exo -64.16 -4.34 7.58 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 123.113 2.542 . . . . 0.0 113.425 -174.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 7.0 mp -93.36 -20.83 19.97 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.663 0.268 . . . . 0.0 111.113 -179.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.62 -16.93 60.25 Favored Glycine 0 N--CA 1.453 -0.231 0 N-CA-C 110.774 -0.93 . . . . 0.0 110.774 -172.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.755 ' HB3' ' HD2' ' A' ' 49' ' ' PRO . 0.4 OUTLIER -69.43 170.05 10.39 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 114.72 -0.74 . . . . 0.0 109.594 171.726 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.827 ' HD3' ' HD3' ' A' ' 62' ' ' ARG . 5.6 Cg_exo -32.37 150.0 0.02 OUTLIER 'Trans proline' 0 C--N 1.361 1.209 0 C-N-CA 124.849 3.699 . . . . 0.0 116.718 -155.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.489 HG23 ' HA ' ' A' ' 43' ' ' ILE . 69.1 mt -124.07 134.22 67.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-N 113.684 -1.598 . . . . 0.0 109.634 -173.642 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.448 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 2.3 mp0 -78.76 120.69 23.76 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 177.686 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.457 ' O ' ' HA ' ' A' ' 58' ' ' SER . 27.3 m -128.4 160.01 39.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.666 -178.009 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -112.37 130.82 55.83 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.715 -173.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.5 t -104.09 -34.44 8.41 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.979 176.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 34.1 mtp180 -153.34 -89.35 0.05 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.526 177.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -112.89 0.79 15.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.484 -178.084 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.5 t -133.0 154.7 50.27 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.878 -177.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.457 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 7.2 m -104.92 139.21 39.97 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.663 -178.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.448 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 7.4 mp -118.0 173.23 6.89 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.942 178.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -142.52 141.78 32.13 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.667 0.27 . . . . 0.0 110.766 -179.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.476 ' O ' ' HA ' ' A' ' 49' ' ' PRO . 3.3 pp -143.97 150.99 39.16 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 178.638 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.827 ' HD3' ' HD3' ' A' ' 49' ' ' PRO . 32.1 mmt180 -73.77 174.16 8.82 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 121.382 0.611 . . . . 0.0 111.173 -176.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.411 ' HD2' HH11 ' A' ' 63' ' ' ARG . 16.9 ptt180 -70.35 -33.7 71.77 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.895 179.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.445 ' HD2' ' C ' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -57.41 -47.4 81.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.074 174.14 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -68.28 -37.7 80.93 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.955 -177.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 38.8 tp -59.31 -38.94 81.54 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.842 177.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.93 -25.63 63.75 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.153 -178.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 82.0 mt -83.91 -8.6 59.14 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.23 -177.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.665 HD11 HD13 ' A' ' 32' ' ' LEU . 96.9 mt -103.86 132.7 49.86 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 110.251 -0.277 . . . . 0.0 110.251 178.036 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.0 m -89.43 114.18 25.62 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 175.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.597 ' CD2' HG12 ' A' ' 12' ' ' ILE . 73.6 mt -118.71 132.21 56.15 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.001 -173.391 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 27.2 m -122.06 132.77 24.19 Favored Pre-proline 0 C--N 1.318 -0.804 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.625 173.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -69.45 163.41 38.11 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 121.84 1.693 . . . . 0.0 112.426 -176.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.472 HD11 ' HB2' ' A' ' 9' ' ' SER . 85.9 mt -67.04 -14.97 63.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.732 173.116 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.6 t0 . . . . . 0 C--O 1.252 1.204 0 O-C-N 124.165 0.916 . . . . 0.0 110.318 -178.231 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.482 1.128 0 CA-C-O 121.024 0.44 . . . . 0.0 109.827 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.5 t -104.07 110.37 22.52 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 177.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -95.95 99.18 10.99 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.297 -178.009 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.614 ' HG ' HG13 ' A' ' 41' ' ' VAL . 6.4 mp -97.48 122.41 40.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.189 -0.459 . . . . 0.0 109.811 175.785 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -122.29 85.02 47.0 Favored Pre-proline 0 C--N 1.32 -0.674 0 N-CA-C 109.408 -0.589 . . . . 0.0 109.408 177.294 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.536 ' HA ' HG13 ' A' ' 40' ' ' VAL . 40.5 Cg_endo -69.27 105.36 1.39 Allowed 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 122.274 1.983 . . . . 0.0 112.861 -176.367 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.9 t -82.99 -54.67 4.89 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.172 176.156 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 -155.79 144.77 20.58 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 176.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.533 ' HB2' HD11 ' A' ' 74' ' ' LEU . 15.1 m -90.94 140.7 29.58 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 -179.598 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -124.27 142.22 51.43 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.843 0.354 . . . . 0.0 110.7 -175.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.597 ' HG3' HD23 ' A' ' 74' ' ' LEU . 90.6 mtt-85 -99.05 157.25 16.47 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.717 175.422 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 49.7 mt -94.07 112.99 27.85 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.739 179.006 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.96 -33.35 70.38 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.434 0.635 . . . . 0.0 110.156 178.154 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.555 ' HA2' ' HB3' ' A' ' 34' ' ' PRO . . . 153.94 -147.36 16.59 Favored Glycine 0 N--CA 1.444 -0.807 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.329 -179.655 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -113.61 160.56 18.43 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 -179.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.441 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 34.0 t -62.8 133.01 94.96 Favored Pre-proline 0 C--N 1.321 -0.665 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 172.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 31.7 Cg_exo -60.1 -16.53 40.2 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.895 2.396 . . . . 0.0 112.727 -178.683 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -103.6 24.33 11.3 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.081 -178.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 18.4 tt -71.2 155.01 7.67 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 175.564 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.1 p -124.24 127.15 47.26 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -172.113 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.417 ' HB3' ' H ' ' A' ' 22' ' ' GLY . 16.7 m120 64.94 -156.32 0.29 Allowed 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.222 -0.899 . . . . 0.0 112.478 168.615 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.417 ' H ' ' HB3' ' A' ' 21' ' ' ASN . . . -75.14 15.09 4.39 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 115.337 -0.847 . . . . 0.0 113.356 -175.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.406 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 29.1 t80 -61.95 -36.09 80.38 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 174.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 4.4 tmm_? -64.62 -39.77 94.29 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.373 175.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -68.58 -35.31 77.2 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.246 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -64.4 -41.44 96.64 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.691 176.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.825 HD13 HD21 ' A' ' 69' ' ' LEU . 83.7 mt -67.17 -43.66 81.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.186 177.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -59.5 -44.58 93.05 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.502 178.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.3 m -64.24 -33.77 76.58 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.886 179.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 70.4 mtm -78.12 -16.47 57.93 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.327 -178.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 112.78 11.87 13.7 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.427 -0.892 . . . . 0.0 113.013 174.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 94.4 mt -100.63 95.9 7.0 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.794 0.331 . . . . 0.0 110.321 179.447 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -132.52 152.81 80.66 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.686 -179.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.555 ' HB3' ' HA2' ' A' ' 14' ' ' GLY . 24.0 Cg_endo -62.4 139.14 75.22 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.855 2.37 . . . . 0.0 112.132 179.11 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 107.36 -26.33 18.84 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.298 178.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.07 -172.47 4.15 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 121.141 0.496 . . . . 0.0 110.212 -178.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.563 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -145.28 144.06 30.55 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.066 -176.606 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.419 HD13 HG21 ' A' ' 52' ' ' VAL . 84.1 mt -118.47 137.82 52.92 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.687 178.013 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 40.2 ttt85 -101.71 117.62 35.25 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.546 ' HA ' HG12 ' A' ' 52' ' ' VAL . 14.5 p -62.48 127.1 21.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.66 0.743 . . . . 0.0 111.707 -176.253 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.614 HG13 ' HG ' ' A' ' 4' ' ' LEU . 91.6 t -90.4 -61.26 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.969 170.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 50.1 mtp180 -167.13 155.43 9.69 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 123.72 0.638 . . . . 0.0 111.597 -177.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.485 HG23 ' HD2' ' A' ' 49' ' ' PRO . 3.3 mp -117.15 116.7 52.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 163.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -54.13 135.02 59.29 Favored Pre-proline 0 C--N 1.326 -0.416 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -67.86 -1.58 7.12 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.812 2.341 . . . . 0.0 112.141 179.133 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.42 HD13 ' HA ' ' A' ' 46' ' ' LEU . 3.9 mm? -63.8 -28.8 70.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.577 174.268 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 157.46 -76.59 0.2 Allowed Glycine 0 N--CA 1.438 -1.181 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.939 -176.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -167.78 120.01 0.72 Allowed Pre-proline 0 N--CA 1.448 -0.543 0 N-CA-C 113.882 1.067 . . . . 0.0 113.882 176.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.485 ' HD2' HG23 ' A' ' 43' ' ' ILE . 81.1 Cg_endo -118.67 -168.72 0.02 OUTLIER 'Trans proline' 0 N--CA 1.433 -2.055 1 C-N-CA 126.372 4.715 . . . . 0.0 108.243 140.318 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.741 HD12 HD11 ' A' ' 61' ' ' LEU . 62.6 mt -140.67 100.62 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 168.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.439 ' OE1' ' HB2' ' A' ' 60' ' ' ALA . 5.3 tp60 -86.93 116.52 25.04 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 178.478 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.546 HG12 ' HA ' ' A' ' 40' ' ' VAL . 11.5 m -136.79 175.97 8.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.528 0.204 . . . . 0.0 110.56 -177.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.44 ' HG2' ' H ' ' A' ' 55' ' ' ARG . 40.8 tt0 -147.17 138.88 24.19 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 176.065 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -86.16 27.23 0.93 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.093 0.473 . . . . 0.0 109.912 176.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.44 ' H ' ' HG2' ' A' ' 53' ' ' GLU . 43.3 ttm105 67.1 16.01 10.19 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 121.904 0.859 . . . . 0.0 109.923 -175.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -139.42 -70.55 0.4 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.382 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 17.0 m -114.61 141.65 47.5 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.046 177.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 23.1 p -85.32 146.98 26.76 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.954 0.407 . . . . 0.0 110.491 176.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 15.9 mt -141.19 167.35 22.38 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.639 -179.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.499 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -137.93 154.77 49.38 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 114.678 -1.146 . . . . 0.0 109.873 -179.385 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.741 HD11 HD12 ' A' ' 50' ' ' ILE . 1.3 pp -157.31 168.3 27.78 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 -179.785 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.648 ' HD3' ' OD2' ' A' ' 65' ' ' ASP . 0.1 OUTLIER -107.63 172.49 6.8 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.042 0.449 . . . . 0.0 110.329 -176.899 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.504 ' HG3' ' N ' ' A' ' 64' ' ' LYS . 0.2 OUTLIER -59.97 -34.03 72.74 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.549 174.258 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.504 ' N ' ' HG3' ' A' ' 63' ' ' ARG . 1.5 tmtp? -62.5 -40.91 98.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.969 -1.014 . . . . 0.0 110.297 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.648 ' OD2' ' HD3' ' A' ' 62' ' ' ARG . 26.1 m-20 -72.94 -37.86 66.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.797 179.168 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 53.0 tp -61.27 -31.63 71.45 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.481 177.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.11 -10.9 60.41 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.302 178.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 95.9 mt -110.59 -5.29 15.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.962 0.411 . . . . 0.0 110.815 179.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.825 HD21 HD13 ' A' ' 27' ' ' LEU . 98.7 mt -123.53 125.29 44.62 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.623 -177.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 6.7 m -91.53 114.25 26.73 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.009 0.433 . . . . 0.0 110.065 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 8.9 mp -125.65 143.61 50.96 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.466 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 15.6 m -137.23 159.15 70.82 Favored Pre-proline 0 C--N 1.32 -0.697 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.643 178.143 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -61.29 167.64 9.09 Favored 'Trans proline' 0 C--O 1.234 0.284 0 C-N-CA 122.206 1.938 . . . . 0.0 112.068 177.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.597 HD23 ' HG3' ' A' ' 11' ' ' ARG . 86.3 mt -54.42 -56.25 20.57 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.985 0.421 . . . . 0.0 110.383 176.441 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.6 t0 . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.259 -0.876 . . . . 0.0 109.287 177.858 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.5 mpp? . . . . . 0 N--CA 1.481 1.113 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.7 m 61.28 86.7 0.1 Allowed 'General case' 0 C--N 1.33 -0.272 0 O-C-N 123.759 0.662 . . . . 0.0 111.755 178.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -72.13 93.58 1.44 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.905 177.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 80.9 mt -109.71 106.87 16.69 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.055 -174.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 21.7 pt20 -122.61 88.09 49.63 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 116.022 -0.536 . . . . 0.0 109.923 176.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -71.01 150.26 60.31 Favored 'Trans proline' 0 N--CA 1.463 -0.288 0 C-N-CA 122.949 2.433 . . . . 0.0 112.154 -179.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 38.5 t -92.31 -74.11 0.53 Allowed 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 177.003 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.411 ' O ' HG12 ' A' ' 40' ' ' VAL . 87.9 mtt180 -133.68 179.67 6.09 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 121.384 0.612 . . . . 0.0 110.884 -179.08 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 37.3 m -124.59 129.64 50.95 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.085 176.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -113.99 149.18 35.72 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.917 0.389 . . . . 0.0 110.87 -174.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 78.7 mtp180 -105.46 153.24 21.98 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 174.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.662 HD12 ' HB3' ' A' ' 36' ' ' ALA . 35.2 mt -97.2 105.58 17.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 177.354 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.66 -31.45 71.46 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.4 0.619 . . . . 0.0 110.188 179.059 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 160.09 -153.49 24.46 Favored Glycine 0 N--CA 1.443 -0.89 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.311 -178.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 66.2 m-85 -99.38 162.39 13.07 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 179.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.7 t -69.63 132.67 89.05 Favored Pre-proline 0 C--N 1.317 -0.845 0 N-CA-C 109.103 -0.702 . . . . 0.0 109.103 172.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -63.33 -7.07 11.29 Favored 'Trans proline' 0 C--O 1.233 0.255 0 C-N-CA 122.595 2.197 . . . . 0.0 112.67 -178.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.37 1.71 56.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.287 178.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 14.7 tt -75.12 146.75 9.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 179.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.7 t -160.37 -178.95 7.28 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 121.166 -0.214 . . . . 0.0 110.451 -177.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.4 t30 70.78 7.4 6.2 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 123.731 0.812 . . . . 0.0 111.767 175.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.7 14.13 61.79 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.542 -0.837 . . . . 0.0 113.051 177.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -65.28 -24.16 67.23 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.002 0.429 . . . . 0.0 110.085 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.411 HH11 ' HD3' ' A' ' 24' ' ' ARG . 25.8 ttt180 -53.1 -48.66 67.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.578 173.566 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -64.98 -28.17 69.33 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.353 -179.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 26.5 tpt180 -74.33 -40.96 61.84 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.852 176.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.68 HD22 HD12 ' A' ' 32' ' ' LEU . 46.1 mt -66.91 -42.1 86.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.755 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -59.72 -43.15 94.29 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.923 177.081 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 70.1 m -63.15 -30.69 71.79 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.323 177.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 89.3 mtp -80.23 -16.18 55.34 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.218 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 108.98 10.82 23.76 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.479 -0.867 . . . . 0.0 112.647 176.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.903 HD13 HD11 ' A' ' 69' ' ' LEU . 84.8 mt -101.42 100.11 10.54 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.961 0.41 . . . . 0.0 109.925 179.374 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.408 ' H ' HD23 ' A' ' 33' ' ' LEU . 1.9 pt? -131.8 156.12 80.52 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.817 -177.463 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -64.69 125.44 14.88 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.719 2.28 . . . . 0.0 111.473 176.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 109.55 -1.07 30.73 Favored Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.652 -0.785 . . . . 0.0 112.838 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.662 ' HB3' HD12 ' A' ' 12' ' ' ILE . . . -88.4 -172.75 3.9 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 120.989 0.423 . . . . 0.0 110.046 178.807 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -158.13 146.88 19.09 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.455 -177.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.437 HD13 HG21 ' A' ' 52' ' ' VAL . 82.5 mt -137.74 139.85 40.35 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.925 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 52.5 ttm-85 -101.72 124.85 48.05 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 175.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.603 ' HA ' HG12 ' A' ' 52' ' ' VAL . 9.3 p -75.88 122.69 30.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.522 0.677 . . . . 0.0 110.622 -177.239 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.599 HG12 ' HG3' ' A' ' 42' ' ' ARG . 48.9 t -93.73 -52.9 9.13 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.36 178.279 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.599 ' HG3' HG12 ' A' ' 41' ' ' VAL . 96.5 mtt180 -152.74 140.39 19.86 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -174.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.453 HD11 HG21 ' A' ' 40' ' ' VAL . 4.5 mp -116.27 144.22 24.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 164.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.603 ' H ' ' CD ' ' A' ' 49' ' ' PRO . . . -81.94 138.36 46.42 Favored Pre-proline 0 C--N 1.318 -0.785 0 CA-C-N 117.788 0.267 . . . . 0.0 110.923 178.645 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -66.14 -5.31 12.07 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 123.24 2.626 . . . . 0.0 112.56 179.489 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -65.53 -35.89 82.2 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.206 174.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 158.65 -77.49 0.19 Allowed Glycine 0 N--CA 1.438 -1.226 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.037 -176.197 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -153.62 120.03 2.88 Favored Pre-proline 0 N--CA 1.445 -0.724 0 N-CA-C 114.501 1.297 . . . . 0.0 114.501 179.302 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.603 ' CD ' ' H ' ' A' ' 44' ' ' ALA . 94.6 Cg_endo -119.51 -173.51 0.02 OUTLIER 'Trans proline' 0 N--CA 1.436 -1.854 1 C-N-CA 126.482 4.788 . . . . 0.0 107.693 131.301 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.732 HG22 HG13 ' A' ' 52' ' ' VAL . 57.1 mt -142.1 100.85 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.425 0 C-N-CA 119.749 -0.78 . . . . 0.0 109.942 170.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.585 HE22 ' HB3' ' A' ' 58' ' ' SER . 0.0 OUTLIER -87.57 112.57 22.41 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 178.437 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.732 HG13 HG22 ' A' ' 50' ' ' ILE . 24.2 m -129.41 -177.12 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.831 0.348 . . . . 0.0 110.59 -177.058 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -133.74 132.1 40.18 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 174.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.4 m -76.79 -30.98 56.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.082 0.467 . . . . 0.0 110.931 -176.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.408 ' HD3' HH11 ' A' ' 55' ' ' ARG . 9.3 ptp180 173.72 -26.26 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.642 -178.406 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -155.25 -36.73 0.09 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.166 -179.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.7 t -96.88 141.73 29.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.416 -179.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.585 ' HB3' HE22 ' A' ' 51' ' ' GLN . 45.4 m -80.95 146.59 30.67 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.618 178.445 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.8 tp -138.62 159.92 40.9 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.296 -179.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.572 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -138.94 156.84 46.93 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.927 -0.398 . . . . 0.0 109.927 177.74 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.656 HD11 HD12 ' A' ' 50' ' ' ILE . 3.7 pp -161.94 168.8 22.28 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -178.119 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.648 ' HD3' ' OD2' ' A' ' 65' ' ' ASP . 0.0 OUTLIER -109.43 169.04 8.95 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.448 0.642 . . . . 0.0 111.293 -177.603 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.572 ' HD2' ' N ' ' A' ' 64' ' ' LYS . 2.0 ppt_? -58.35 -33.25 69.35 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.69 -1.141 . . . . 0.0 111.796 176.223 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.572 ' N ' ' HD2' ' A' ' 63' ' ' ARG . 88.6 tttt -63.96 -44.61 92.27 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.489 176.406 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.648 ' OD2' ' HD3' ' A' ' 62' ' ' ARG . 23.3 m-20 -65.94 -36.8 84.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.287 0.565 . . . . 0.0 109.596 177.757 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.3 tp -59.25 -35.68 74.12 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.621 175.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.87 -10.48 58.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.622 -178.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 78.5 mt -94.84 -13.85 25.15 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.958 0.409 . . . . 0.0 110.444 178.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.903 HD11 HD13 ' A' ' 32' ' ' LEU . 96.7 mt -115.03 150.08 36.44 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.071 0.462 . . . . 0.0 110.865 -177.615 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 22.6 m -108.51 118.89 37.95 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.368 -0.605 . . . . 0.0 109.368 170.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 77.9 mt -120.02 138.41 53.53 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.99 -174.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.427 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 19.7 m -130.73 134.42 25.99 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.659 174.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 72' ' ' VAL . 27.7 Cg_exo -62.07 164.59 16.55 Favored 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 122.283 1.989 . . . . 0.0 112.103 179.499 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 96.0 mt -53.25 -42.1 66.13 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.538 175.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 33.9 t70 . . . . . 0 C--O 1.247 0.962 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.77 177.607 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.0 ttm . . . . . 0 N--CA 1.479 1.006 0 CA-C-O 120.624 0.25 . . . . 0.0 110.907 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.0 m -78.3 108.59 11.74 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -174.028 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 70.34 151.87 0.1 Allowed 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.071 -0.968 . . . . 0.0 112.592 174.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 92.9 mt -136.32 152.27 50.49 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.122 175.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.4 pm0 -88.22 149.79 45.74 Favored Pre-proline 0 C--N 1.322 -0.589 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.66 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 18.0 Cg_endo -61.28 104.4 0.29 Allowed 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 121.914 1.742 . . . . 0.0 110.687 175.608 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 29.7 t -93.52 -76.73 0.47 Allowed 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.176 -171.053 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.413 ' HD2' ' HA ' ' A' ' 8' ' ' ARG . 0.5 OUTLIER -93.66 164.88 12.98 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.99 0.424 . . . . 0.0 110.487 -177.057 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.462 ' OG ' ' HG3' ' A' ' 39' ' ' ARG . 16.6 m -132.51 139.18 47.81 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.886 178.386 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.402 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 59.3 m-85 -120.4 133.44 55.43 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.116 -177.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.66 HH11 ' HB2' ' A' ' 37' ' ' ALA . 21.8 mmm180 -89.21 148.52 23.57 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 178.33 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.54 HG12 ' CD2' ' A' ' 71' ' ' LEU . 47.7 mt -102.42 113.06 37.87 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 175.364 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 4.5 p -81.21 -23.37 38.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.859 0.361 . . . . 0.0 110.904 179.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 161.75 -145.89 11.43 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 120.457 -0.878 . . . . 0.0 112.102 -178.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -117.99 154.55 31.78 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.161 0.505 . . . . 0.0 110.889 -175.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.435 ' O ' HG22 ' A' ' 19' ' ' ILE . 43.3 t -73.64 139.99 78.05 Favored Pre-proline 0 C--N 1.318 -0.782 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.319 174.148 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 31.3 Cg_exo -60.5 -8.73 9.43 Favored 'Trans proline' 0 N--CA 1.475 0.398 0 C-N-CA 123.152 2.568 . . . . 0.0 113.341 -178.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.63 -6.36 58.93 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.515 179.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.435 HG22 ' O ' ' A' ' 16' ' ' SER . 16.5 tt -79.23 139.47 18.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-O 120.909 0.385 . . . . 0.0 110.006 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.8 p -153.41 170.97 19.4 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -176.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 67.62 38.01 3.17 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.578 172.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.94 21.04 75.12 Favored Glycine 0 N--CA 1.454 -0.136 0 C-N-CA 121.027 -0.606 . . . . 0.0 113.594 174.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.416 ' HB3' ' CG1' ' A' ' 19' ' ' ILE . 7.3 t80 -66.83 -22.83 65.99 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.829 0.347 . . . . 0.0 110.446 -177.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 32.1 mtp180 -64.52 -40.89 96.45 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.663 175.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -69.12 -35.52 76.5 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 120.989 0.423 . . . . 0.0 110.141 179.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -66.06 -42.18 89.78 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.872 177.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.566 HD22 HD12 ' A' ' 32' ' ' LEU . 61.2 mt -70.97 -34.95 71.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.537 -179.785 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -58.46 -44.32 89.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.35 176.405 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 49.3 m -61.44 -35.34 77.31 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.806 178.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 91.9 mtp -75.79 -36.34 59.78 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.51 -178.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.04 14.97 5.34 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.202 -178.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.566 HD12 HD22 ' A' ' 27' ' ' LEU . 94.5 mt -104.46 91.98 4.12 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.911 0.386 . . . . 0.0 110.25 179.375 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.491 ' HB2' ' HD2' ' A' ' 34' ' ' PRO . 1.7 pt? -137.83 160.54 64.35 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.392 -179.224 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.491 ' HD2' ' HB2' ' A' ' 33' ' ' LEU . 13.8 Cg_endo -57.44 129.99 36.78 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.797 2.331 . . . . 0.0 111.659 176.716 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 110.75 -17.27 27.93 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.227 -177.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.66 100.55 12.9 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.913 0.387 . . . . 0.0 110.714 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.66 ' HB2' HH11 ' A' ' 11' ' ' ARG . . . -75.8 134.55 40.37 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.906 177.421 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 34.7 mt -110.21 135.91 50.25 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.567 -178.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.565 ' HB2' ' HB3' ' A' ' 53' ' ' GLU . 0.3 OUTLIER -94.55 147.44 23.27 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 172.928 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.66 ' O ' ' HA ' ' A' ' 6' ' ' PRO . 11.8 p -85.15 124.11 39.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-O 120.831 0.348 . . . . 0.0 111.036 -176.318 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 96.0 t -102.63 -50.19 9.93 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 C-N-CA 120.776 -0.37 . . . . 0.0 110.678 173.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.401 ' HB2' ' HE ' ' A' ' 42' ' ' ARG . 2.1 ttm180 -177.12 158.04 1.46 Allowed 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -175.801 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.403 HG23 ' CB ' ' A' ' 48' ' ' ASP . 46.7 mm -129.85 141.7 45.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 170.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.504 ' HB2' ' CD ' ' A' ' 49' ' ' PRO . . . -65.63 152.54 92.51 Favored Pre-proline 0 N--CA 1.469 0.522 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -179.49 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -69.07 -32.1 22.17 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 122.728 2.285 . . . . 0.0 112.616 175.66 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.413 HD13 ' HA ' ' A' ' 46' ' ' LEU . 4.0 mm? -65.51 -88.58 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.809 0.814 . . . . 0.0 110.45 177.095 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.542 ' O ' ' HB3' ' A' ' 48' ' ' ASP . . . -115.08 -79.27 0.82 Allowed Glycine 0 N--CA 1.432 -1.602 0 N-CA-C 109.119 -1.592 . . . . 0.0 109.119 169.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.559 ' OD1' ' HD3' ' A' ' 63' ' ' ARG . 6.0 p-10 166.98 133.3 0.04 OUTLIER Pre-proline 0 N--CA 1.451 -0.423 0 N-CA-C 113.925 1.083 . . . . 0.0 113.925 -178.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.504 ' CD ' ' HB2' ' A' ' 44' ' ' ALA . 7.5 Cg_endo -96.65 152.09 1.17 Allowed 'Trans proline' 0 N--CA 1.432 -2.134 0 N-CA-C 106.828 -2.028 . . . . 0.0 106.828 132.501 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.729 HD13 HD22 ' A' ' 66' ' ' LEU . 62.1 mt -106.23 100.69 11.15 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.695 0 C-N-CA 119.566 -0.853 . . . . 0.0 110.092 -173.802 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -82.4 117.0 22.13 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.711 178.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.521 HG13 HG22 ' A' ' 50' ' ' ILE . 31.1 m -137.4 172.51 14.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.04 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.565 ' HB3' ' HB2' ' A' ' 39' ' ' ARG . 42.9 tt0 -123.18 123.02 39.85 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 176.121 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.7 p -85.14 -30.79 23.7 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.795 -173.091 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 46.8 ttp180 -174.17 -46.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.861 0.362 . . . . 0.0 110.862 179.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 21.9 mt-30 -134.37 -27.13 1.39 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.747 -175.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.8 t -125.8 160.64 29.3 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.852 0.358 . . . . 0.0 111.016 -176.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.3 m -86.08 142.93 28.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.276 177.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 10.3 tt -137.96 145.24 41.75 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.086 -178.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.539 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -121.74 143.51 49.33 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.414 179.054 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.2 pp -150.87 176.55 10.98 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 -178.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -96.42 156.15 16.46 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.477 0.655 . . . . 0.0 111.704 -177.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.559 ' HD3' ' OD1' ' A' ' 48' ' ' ASP . 28.0 ptt-85 -65.11 -33.61 76.43 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.664 179.266 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -55.43 -43.95 75.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.28 176.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -68.47 -39.46 81.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.555 177.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.926 HD11 HD11 ' A' ' 71' ' ' LEU . 18.6 tp -65.45 -29.04 69.67 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.987 -179.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.65 -15.91 63.67 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.84 178.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.43 ' HA ' ' HB3' ' A' ' 16' ' ' SER . 93.5 mt -96.92 -3.72 41.31 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.697 178.371 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.2 mt -110.3 130.0 55.63 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.133 178.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 31.4 m -92.1 116.41 28.91 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.348 0.594 . . . . 0.0 110.416 177.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.926 HD11 HD11 ' A' ' 66' ' ' LEU . 77.2 mt -108.57 144.77 35.82 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.102 -176.449 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.419 HG23 ' HB2' ' A' ' 11' ' ' ARG . 15.9 m -132.33 119.23 16.37 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.505 170.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' ' 10' ' ' TYR . 23.5 Cg_exo -63.5 163.15 24.9 Favored 'Trans proline' 0 C--O 1.237 0.473 0 C-N-CA 122.209 1.939 . . . . 0.0 112.293 -178.165 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.416 ' CD1' ' HB2' ' A' ' 9' ' ' SER . 61.0 mt -65.68 -30.4 71.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.335 173.325 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 . . . . . 0 C--O 1.251 1.132 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.779 178.443 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 mpt? . . . . . 0 N--CA 1.482 1.137 0 CA-C-O 120.551 0.215 . . . . 0.0 111.46 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.9 t -76.3 104.09 6.65 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.031 0.443 . . . . 0.0 109.9 178.389 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -131.94 146.75 52.28 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.657 -178.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 95.0 mt 52.4 72.68 0.39 Allowed 'General case' 0 C--N 1.329 -0.298 0 O-C-N 124.119 0.887 . . . . 0.0 113.192 179.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -113.41 92.23 22.52 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 168.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -77.17 117.56 4.45 Favored 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 122.849 2.366 . . . . 0.0 113.051 -173.116 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.5 m -73.2 -37.81 66.34 Favored 'General case' 0 N--CA 1.44 -0.964 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.446 175.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.6 mtt180 -155.18 157.13 36.91 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.499 -178.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.532 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 39.1 m -122.57 130.27 52.83 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.837 -1.074 . . . . 0.0 108.513 170.118 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -110.5 142.03 42.83 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.373 -177.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 12.9 ptt180 -108.05 148.67 29.45 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.303 0.573 . . . . 0.0 110.493 177.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.568 HG12 ' CD2' ' A' ' 71' ' ' LEU . 22.4 mt -90.2 113.34 26.12 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.618 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 10.5 t -91.13 -11.04 39.72 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.744 -0.382 . . . . 0.0 111.143 -178.062 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.666 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 161.36 -168.47 36.6 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.343 -0.932 . . . . 0.0 112.211 177.295 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -98.54 157.06 16.47 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 177.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.4 t -59.24 140.16 87.9 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.642 175.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -65.17 -14.57 45.85 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.271 1.981 . . . . 0.0 111.596 175.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -102.69 12.66 36.0 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.14 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.506 HG13 HD22 ' A' ' 68' ' ' LEU . 12.3 tt -76.27 146.24 9.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.126 0.489 . . . . 0.0 111.006 -177.556 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.571 ' HB2' ' HD2' ' A' ' 23' ' ' TYR . 20.4 m -84.03 145.61 28.4 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.861 175.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -57.25 -43.08 82.66 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.021 0.378 . . . . 0.0 112.021 -175.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -67.51 -35.83 87.4 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.24 -179.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.571 ' HD2' ' HB2' ' A' ' 20' ' ' SER . 19.2 m-85 -67.49 -35.3 78.88 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 122.847 -0.208 . . . . 0.0 110.776 177.688 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 74.2 ttt-85 -62.55 -40.25 96.24 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 174.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -66.59 -40.67 88.99 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.704 177.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 52.9 ttt180 -61.29 -45.46 94.4 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.345 176.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 23' ' ' TYR . 66.9 mt -65.95 -42.84 89.48 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.604 -178.139 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -60.83 -43.32 98.42 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.949 178.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 59.2 m -66.78 -29.59 69.57 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.381 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 84.2 mtp -77.91 -18.11 56.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.037 177.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 103.38 15.01 24.42 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.374 178.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.565 HD13 HD11 ' A' ' 69' ' ' LEU . 92.3 mt -100.93 97.94 8.47 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.008 0.432 . . . . 0.0 110.117 -179.52 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.401 HD23 ' H ' ' A' ' 33' ' ' LEU . 1.9 pt? -132.9 159.2 73.56 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.133 -177.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.666 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 37.1 Cg_exo -60.47 128.58 26.48 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.653 2.236 . . . . 0.0 111.455 176.361 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 115.37 -12.73 18.92 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 120.668 -0.777 . . . . 0.0 111.891 -176.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.5 ' HB3' HD12 ' A' ' 12' ' ' ILE . . . -89.41 176.47 6.9 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-O 121.329 0.585 . . . . 0.0 110.09 179.156 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -147.19 150.65 35.32 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.134 -177.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 55.3 mt -127.53 131.34 50.07 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.66 177.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -107.67 127.69 53.89 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.704 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 14.7 p -62.17 124.72 17.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.174 0.511 . . . . 0.0 111.592 -176.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 85.1 t -97.26 -52.92 8.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.696 173.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 38.6 mtp-105 -151.54 157.01 41.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.137 179.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.478 HG12 HG23 ' A' ' 50' ' ' ILE . 64.9 mt -127.65 131.87 69.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 176.252 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.459 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -65.13 141.41 98.28 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.384 178.565 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 32.0 Cg_exo -59.24 -16.0 31.9 Favored 'Trans proline' 0 N--CA 1.476 0.48 0 C-N-CA 123.259 2.639 . . . . 0.0 113.65 -174.588 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.428 ' N ' HD22 ' A' ' 46' ' ' LEU . 2.2 mm? -89.12 -16.98 30.16 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.702 0.287 . . . . 0.0 111.202 -177.563 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.72 -16.86 60.39 Favored Glycine 0 N--CA 1.454 -0.125 0 N-CA-C 111.016 -0.833 . . . . 0.0 111.016 -174.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.905 ' HB3' ' HD2' ' A' ' 49' ' ' PRO . 1.5 m-20 -65.62 170.6 4.56 Favored Pre-proline 0 C--N 1.326 -0.448 0 C-N-CA 123.601 0.761 . . . . 0.0 110.616 173.346 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.905 ' HD2' ' HB3' ' A' ' 48' ' ' ASP . 23.3 Cg_exo -19.77 151.38 0.0 OUTLIER 'Trans proline' 0 C--N 1.366 1.459 1 C-N-CA 126.675 4.917 . . . . 0.0 117.434 -163.693 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.497 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 62.3 mt -123.6 138.8 52.18 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 CA-C-N 113.862 -1.517 . . . . 0.0 110.604 -166.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 27.8 mp0 -86.04 119.35 26.25 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 175.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 28.3 m -130.83 159.11 43.11 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.824 -176.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -116.41 141.83 47.66 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 -178.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.43 ' O ' ' HB2' ' A' ' 55' ' ' ARG . 35.4 p -97.69 -45.15 6.48 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.356 0.598 . . . . 0.0 109.879 179.438 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.43 ' HB2' ' O ' ' A' ' 54' ' ' THR . 0.0 OUTLIER 167.66 -46.46 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 114.508 -1.224 . . . . 0.0 107.971 -173.238 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.53 -54.91 2.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.0 -175.706 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.9 t -126.86 144.34 51.01 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.041 -172.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 9.9 m -91.62 139.27 30.86 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.643 -178.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.7 mp -121.14 168.91 11.06 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.789 -178.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.497 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -142.18 124.9 15.93 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.321 175.019 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.576 ' HB2' ' HB2' ' A' ' 65' ' ' ASP . 3.5 pp -126.56 146.66 50.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.642 -173.119 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.715 ' HG3' ' HG3' ' A' ' 49' ' ' PRO . 1.0 OUTLIER -86.97 178.04 7.06 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.555 -175.172 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 44.5 mtt180 -54.73 -39.35 68.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.764 174.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.487 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 84.2 tttt -61.76 -50.68 71.39 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.86 179.053 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.576 ' HB2' ' HB2' ' A' ' 61' ' ' LEU . 24.8 m-20 -64.67 -40.05 94.73 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.928 -178.23 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 49.7 tp -59.96 -43.43 95.05 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.07 177.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.9 -13.93 62.2 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -177.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.506 HD22 HG13 ' A' ' 19' ' ' ILE . 97.3 mt -80.11 -28.05 39.09 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.723 0.297 . . . . 0.0 110.607 178.14 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.565 HD11 HD13 ' A' ' 32' ' ' LEU . 96.0 mt -104.71 140.86 37.45 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.414 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.9 m -92.11 113.12 25.3 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 170.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.568 ' CD2' HG12 ' A' ' 12' ' ' ILE . 89.6 mt -113.28 133.4 55.12 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.608 -174.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 17.1 m -129.71 142.02 43.86 Favored Pre-proline 0 C--N 1.316 -0.855 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.561 174.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -67.87 163.24 36.28 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 121.764 1.643 . . . . 0.0 111.416 179.38 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' A' ' 9' ' ' SER . 75.4 mt -59.02 -63.38 1.32 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.741 175.542 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.06 -0.972 . . . . 0.0 110.007 178.965 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.2 ttt . . . . . 0 N--CA 1.48 1.048 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.1 p -109.38 103.81 12.8 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.925 0.393 . . . . 0.0 110.632 178.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -121.96 76.83 1.32 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.247 0.546 . . . . 0.0 109.533 175.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.878 ' HG ' HG13 ' A' ' 41' ' ' VAL . 6.5 mp -107.92 154.34 21.74 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.924 -175.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -146.97 83.69 7.84 Favored Pre-proline 0 C--N 1.322 -0.628 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.037 172.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_exo -65.67 155.54 68.55 Favored 'Trans proline' 0 N--CA 1.463 -0.284 0 C-N-CA 122.984 2.456 . . . . 0.0 112.689 -173.7 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.8 t -133.49 -69.39 0.55 Allowed 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 176.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 54.4 mtt180 -147.12 175.22 10.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.013 0.435 . . . . 0.0 110.611 176.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.1 t -114.17 135.67 53.79 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 174.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -119.92 146.58 45.66 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 -174.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.471 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 2.5 ptp180 -104.09 147.17 27.72 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.133 0.492 . . . . 0.0 110.424 178.543 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.564 HG12 ' CD2' ' A' ' 71' ' ' LEU . 46.9 mt -86.28 113.39 24.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.797 178.055 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 3.5 m -68.4 -35.3 77.45 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.266 0.555 . . . . 0.0 110.146 178.26 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.424 ' HA2' ' HB3' ' A' ' 34' ' ' PRO . . . 159.15 -153.25 24.34 Favored Glycine 0 N--CA 1.44 -1.087 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.112 -178.394 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -100.5 151.62 21.35 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 120.908 0.385 . . . . 0.0 110.098 179.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.427 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 27.9 t -72.14 140.06 82.6 Favored Pre-proline 0 C--N 1.317 -0.833 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.557 176.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 43.5 Cg_exo -57.92 -21.03 47.32 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.664 2.243 . . . . 0.0 112.407 179.121 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.14 16.06 15.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.514 -177.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.522 HD11 HD12 ' A' ' 27' ' ' LEU . 15.7 tt -72.23 154.76 7.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.691 0.281 . . . . 0.0 110.412 179.34 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 21.6 t -84.05 143.78 29.51 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.875 0.369 . . . . 0.0 110.683 -178.051 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -64.3 132.33 49.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.472 178.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.98 -33.69 3.73 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 121.047 -0.596 . . . . 0.0 111.754 -177.471 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.406 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 61.4 t80 -65.83 -35.84 81.81 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.369 0.604 . . . . 0.0 109.539 176.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' A' ' 24' ' ' ARG . 12.3 ttm180 -58.83 -43.11 90.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.047 174.087 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -66.1 -36.5 83.33 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.699 -179.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.412 ' O ' ' HG3' ' A' ' 30' ' ' MET . 39.4 ttm180 -67.93 -40.4 83.35 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.298 176.59 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.57 HD13 HD21 ' A' ' 69' ' ' LEU . 64.2 mt -65.04 -43.68 91.54 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.258 179.248 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -58.1 -46.47 85.48 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.224 175.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.8 t -61.16 -32.86 72.59 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.344 -0.843 . . . . 0.0 110.886 179.068 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.412 ' HG3' ' O ' ' A' ' 26' ' ' ARG . 89.4 mtp -74.65 -22.16 59.04 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.863 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 109.04 16.56 11.21 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.592 -0.813 . . . . 0.0 112.342 178.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.459 HD13 HD11 ' A' ' 69' ' ' LEU . 81.9 mt -104.04 96.96 7.01 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 178.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.47 ' HB2' ' HD2' ' A' ' 34' ' ' PRO . 1.8 pt? -135.67 161.09 64.98 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.342 -177.124 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.47 ' HD2' ' HB2' ' A' ' 33' ' ' LEU . 19.8 Cg_endo -59.8 131.43 39.8 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.43 2.087 . . . . 0.0 111.138 174.681 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.28 9.37 39.08 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.546 -0.835 . . . . 0.0 112.244 -178.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.553 ' O ' HG13 ' A' ' 12' ' ' ILE . . . -111.9 125.63 54.24 Favored 'General case' 0 N--CA 1.445 -0.72 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 177.35 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.471 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -99.75 138.69 36.48 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 121.12 0.486 . . . . 0.0 111.263 178.167 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 64.1 mt -119.44 141.63 48.95 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.396 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.487 ' HD3' ' HB3' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -99.32 154.08 18.46 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 173.607 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 12.5 p -95.97 128.54 47.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-O 121.314 0.578 . . . . 0.0 110.871 -177.045 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.878 HG13 ' HG ' ' A' ' 4' ' ' LEU . 92.8 t -88.06 -52.22 11.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.538 175.607 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 50.5 mtp180 -158.25 136.4 10.79 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.699 179.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.404 HD12 ' N ' ' A' ' 43' ' ' ILE . 4.2 mp -96.73 129.51 46.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 172.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.448 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -69.38 131.28 90.26 Favored Pre-proline 0 C--N 1.324 -0.505 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 176.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 20.1 Cg_exo -66.36 4.58 0.94 Allowed 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 123.053 2.502 . . . . 0.0 113.089 -176.026 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -101.29 -23.67 14.36 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.48 179.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 97.91 -15.9 61.02 Favored Glycine 0 N--CA 1.453 -0.182 0 N-CA-C 110.536 -1.026 . . . . 0.0 110.536 -171.388 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.628 ' CB ' ' HD2' ' A' ' 49' ' ' PRO . 0.6 OUTLIER -64.85 170.29 4.25 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 114.488 -0.856 . . . . 0.0 109.888 170.901 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.669 ' HD3' ' HD3' ' A' ' 62' ' ' ARG . 3.0 Cg_exo -30.75 151.1 0.02 OUTLIER 'Trans proline' 0 C--N 1.361 1.21 0 C-N-CA 125.197 3.931 . . . . 0.0 116.395 -164.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 74.2 mt -121.2 133.34 68.1 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 CA-C-N 113.939 -1.482 . . . . 0.0 109.784 -172.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -79.41 114.37 18.29 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 177.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 35.4 m -121.26 177.55 3.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 179.036 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.487 ' HB3' ' HD3' ' A' ' 39' ' ' ARG . 0.9 OUTLIER -138.66 140.36 38.82 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 -178.119 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 12.6 m -115.0 -32.52 5.72 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 112.219 0.451 . . . . 0.0 112.219 -171.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.602 ' HG3' ' HG2' ' A' ' 56' ' ' GLN . 14.4 tpt180 -178.97 -39.71 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.694 0.283 . . . . 0.0 111.388 -170.483 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.602 ' HG2' ' HG3' ' A' ' 55' ' ' ARG . 14.5 mm100 -130.25 -47.65 1.09 Allowed 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -169.704 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.6 t -144.19 161.03 39.9 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 120.765 0.317 . . . . 0.0 110.91 -172.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.4 m -68.99 146.71 52.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.357 -178.318 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 58.9 tp -131.21 144.88 51.67 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.905 178.579 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -123.99 122.27 37.46 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.846 0.355 . . . . 0.0 110.256 178.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.1 pp -122.44 140.15 53.05 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.039 179.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.669 ' HD3' ' HD3' ' A' ' 49' ' ' PRO . 19.3 mmt180 -67.12 170.06 7.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.449 0.642 . . . . 0.0 112.193 -175.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.4 ptm180 -60.88 -33.6 73.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.226 176.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -64.2 -49.29 72.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.625 175.432 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.463 ' OD1' ' HB2' ' A' ' 62' ' ' ARG . 4.3 m-20 -56.46 -40.82 75.48 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-O 121.223 0.535 . . . . 0.0 109.946 177.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 61.2 tp -58.42 -43.39 88.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.783 176.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -73.27 -12.68 60.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.551 -177.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.496 HD22 ' HA ' ' A' ' 19' ' ' ILE . 97.4 mt -96.8 -16.5 20.78 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.788 179.477 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.57 HD21 HD13 ' A' ' 27' ' ' LEU . 96.1 mt -116.15 118.94 34.22 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.894 0.378 . . . . 0.0 110.286 179.678 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.0 m -77.32 114.16 15.85 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.173 0.511 . . . . 0.0 110.049 -179.282 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.564 ' CD2' HG12 ' A' ' 12' ' ' ILE . 96.1 mt -118.59 127.62 53.77 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.453 -176.711 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 28.5 m -129.73 149.15 72.19 Favored Pre-proline 0 C--N 1.319 -0.74 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 174.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -65.97 163.39 31.29 Favored 'Trans proline' 0 N--CA 1.46 -0.46 0 C-N-CA 121.621 1.547 . . . . 0.0 111.398 177.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 89.3 mt -62.5 -41.87 99.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.164 0.507 . . . . 0.0 109.799 178.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 29.3 t70 . . . . . 0 C--O 1.248 0.994 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.476 175.819 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.9 tpt . . . . . 0 N--CA 1.476 0.868 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.6 m -97.0 108.07 20.73 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.126 0.489 . . . . 0.0 110.702 -177.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -138.14 85.0 2.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.095 179.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -151.08 159.39 44.53 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.429 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.6 tp60 -141.69 83.17 13.27 Favored Pre-proline 0 C--N 1.32 -0.705 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -178.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -85.54 103.29 0.76 Allowed 'Trans proline' 0 N--CA 1.448 -1.159 0 C-N-CA 122.133 1.889 . . . . 0.0 111.299 177.104 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.406 ' H ' ' CG1' ' A' ' 40' ' ' VAL . 18.2 m -95.46 -67.91 0.83 Allowed 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.813 -177.361 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.451 ' O ' HG12 ' A' ' 40' ' ' VAL . 35.3 mmt180 -137.26 174.57 10.47 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 121.455 0.645 . . . . 0.0 110.782 -176.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.467 ' HB2' ' CD1' ' A' ' 74' ' ' LEU . 51.1 m -113.53 133.44 55.24 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.078 172.079 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.4 ' HA ' ' HA ' ' A' ' 73' ' ' PRO . 60.5 m-85 -111.49 127.0 55.56 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -177.456 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.511 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 12.8 ptt180 -98.01 149.25 22.66 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.105 0.479 . . . . 0.0 110.625 -179.443 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.556 HG12 ' CD2' ' A' ' 71' ' ' LEU . 21.8 mt -90.34 118.63 36.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.007 -178.366 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 2.2 p -90.89 -12.24 36.76 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.96 0.41 . . . . 0.0 111.231 178.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.442 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 152.69 -164.81 30.84 Favored Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.717 -0.754 . . . . 0.0 111.912 176.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 48.0 m-85 -97.67 150.96 20.61 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 177.276 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.478 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 20.6 m -68.21 140.62 93.2 Favored Pre-proline 0 C--N 1.317 -0.828 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 177.088 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.478 ' HD3' ' HA ' ' A' ' 16' ' ' SER . 23.6 Cg_exo -64.41 -0.89 3.27 Favored 'Trans proline' 0 CA--C 1.531 0.337 0 C-N-CA 123.047 2.498 . . . . 0.0 113.39 -175.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -105.41 17.24 24.25 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.862 0.363 . . . . 0.0 110.913 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.516 HG13 HD22 ' A' ' 68' ' ' LEU . 11.4 tt -93.73 159.76 2.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.619 -179.505 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 21.8 m -95.92 149.92 21.01 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.627 177.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -59.04 -48.7 80.63 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.411 -178.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.53 -37.16 91.76 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.959 -0.639 . . . . 0.0 112.421 -179.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.511 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 0.1 OUTLIER -72.05 -40.0 68.67 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.546 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 56.5 ttt-85 -57.08 -44.94 83.6 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.216 0.532 . . . . 0.0 110.378 175.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -62.62 -43.42 98.84 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.429 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 -61.92 -42.47 99.13 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.309 177.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.73 HD22 HD12 ' A' ' 32' ' ' LEU . 78.8 mt -66.27 -44.68 82.89 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.314 -179.246 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 42.5 t80 -60.65 -44.68 96.14 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.211 -179.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 54.3 m -67.5 -28.93 68.26 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.499 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 69.5 mtm -82.7 -18.99 38.92 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.744 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 119.17 12.2 7.06 Favored Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 120.156 -1.021 . . . . 0.0 113.546 175.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.73 HD12 HD22 ' A' ' 27' ' ' LEU . 94.3 mt -102.75 97.45 7.61 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.67 -0.492 . . . . 0.0 109.67 177.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.434 ' H ' HD23 ' A' ' 33' ' ' LEU . 1.9 pt? -131.22 152.13 80.06 Favored Pre-proline 0 N--CA 1.449 -0.502 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.89 -176.214 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.442 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 23.7 Cg_exo -64.11 136.2 50.91 Favored 'Trans proline' 0 N--CA 1.463 -0.289 0 C-N-CA 122.728 2.285 . . . . 0.0 111.723 177.039 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 108.98 -14.46 34.1 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.397 -178.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.84 -179.68 7.34 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-O 121.002 0.429 . . . . 0.0 110.094 178.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.511 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -150.69 138.76 20.12 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.954 -176.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.512 ' HB3' ' HB ' ' A' ' 52' ' ' VAL . 1.3 mm? -109.56 127.1 54.24 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.707 177.106 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 18.6 ttm180 -94.21 114.83 27.01 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 176.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.672 ' HA ' HG12 ' A' ' 52' ' ' VAL . 5.7 p -69.77 131.5 34.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.748 0.785 . . . . 0.0 111.858 -169.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.0 t -104.13 -36.86 4.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.723 177.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.2 ttm180 -168.17 140.09 2.91 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -177.493 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.545 HD11 HG21 ' A' ' 40' ' ' VAL . 4.5 mp -118.72 135.1 60.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 164.618 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.674 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -73.99 142.9 80.12 Favored Pre-proline 0 C--N 1.319 -0.718 0 C-N-CA 120.859 -0.336 . . . . 0.0 111.132 -179.296 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -64.9 -12.96 36.9 Favored 'Trans proline' 0 CA--C 1.529 0.274 0 C-N-CA 123.063 2.509 . . . . 0.0 112.138 177.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -59.34 -27.51 65.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.066 177.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.28 -75.03 0.24 Allowed Glycine 0 CA--C 1.494 -1.226 0 N-CA-C 110.493 -1.043 . . . . 0.0 110.493 -176.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -169.49 119.18 0.58 Allowed Pre-proline 0 N--CA 1.45 -0.473 0 CA-C-O 122.333 1.064 . . . . 0.0 112.712 173.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.674 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 55.2 Cg_endo -111.85 179.69 0.04 OUTLIER 'Trans proline' 0 N--CA 1.434 -1.998 1 C-N-CA 125.874 4.383 . . . . 0.0 106.718 136.657 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.868 HG22 HG13 ' A' ' 52' ' ' VAL . 8.4 mt -133.94 105.75 7.64 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.8 0 C-N-CA 118.205 -1.398 . . . . 0.0 110.673 176.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.507 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 25.0 tp60 -86.27 113.56 22.36 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 173.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.868 HG13 HG22 ' A' ' 50' ' ' ILE . 16.3 m -138.44 166.18 23.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-O 120.547 0.213 . . . . 0.0 111.101 -176.097 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -120.27 122.5 41.02 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 174.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.9 m -86.07 -78.96 0.26 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.871 -177.438 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.1 ptt180 -148.24 7.82 0.8 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.196 -179.236 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.3 tp60 -136.38 -64.81 0.59 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.123 0.487 . . . . 0.0 110.519 -172.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.1 t -153.22 -178.61 7.07 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 -179.059 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.506 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 26.6 m -78.9 143.03 36.27 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.345 0.593 . . . . 0.0 111.142 -179.158 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.507 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 6.3 mt -131.63 170.65 14.47 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.066 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.512 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -140.62 147.21 39.01 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.821 179.366 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.472 HD21 ' HB ' ' A' ' 50' ' ' ILE . 1.3 pt? -148.92 158.33 44.09 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.865 -0.421 . . . . 0.0 109.865 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 16.1 mmt180 -100.23 173.35 6.65 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.95 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.59 -34.88 65.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.041 -179.522 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 79.2 tttt -61.71 -51.6 67.72 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.852 0.358 . . . . 0.0 110.76 177.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.463 ' HB3' ' HB2' ' A' ' 61' ' ' LEU . 3.3 t70 -65.3 -38.66 90.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.501 0.667 . . . . 0.0 109.504 -178.525 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.585 HD22 HD11 ' A' ' 50' ' ' ILE . 59.0 tp -60.42 -39.13 86.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.138 176.19 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.02 -17.26 64.36 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.969 -176.303 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.516 HD22 HG13 ' A' ' 19' ' ' ILE . 86.2 mt -83.45 -25.7 30.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.0 0.429 . . . . 0.0 111.005 179.354 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.702 HD11 HD13 ' A' ' 32' ' ' LEU . 88.9 mt -109.69 131.78 54.74 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.712 -176.496 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.3 m -88.37 113.59 24.12 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 175.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.556 ' CD2' HG12 ' A' ' 12' ' ' ILE . 75.4 mt -115.82 132.45 56.64 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.506 -175.363 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.408 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 34.7 m -127.73 141.26 40.5 Favored Pre-proline 0 C--N 1.32 -0.684 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 174.311 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 72' ' ' VAL . 22.8 Cg_exo -64.65 162.29 32.02 Favored 'Trans proline' 0 C--O 1.233 0.257 0 C-N-CA 121.74 1.627 . . . . 0.0 112.343 179.392 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.467 ' CD1' ' HB2' ' A' ' 9' ' ' SER . 75.2 mt -70.31 -45.49 66.15 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.511 173.649 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 32.9 t70 . . . . . 0 C--O 1.244 0.801 0 CA-C-O 118.228 -0.892 . . . . 0.0 109.764 179.015 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.8 ttm . . . . . 0 N--CA 1.481 1.117 0 N-CA-C 110.799 -0.075 . . . . 0.0 110.799 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.0 t 69.25 105.45 0.06 Allowed 'General case' 0 C--O 1.234 0.265 0 O-C-N 123.871 0.732 . . . . 0.0 109.719 -173.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -63.85 104.19 0.66 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.447 -177.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 78.3 mt -75.06 101.42 4.52 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 172.142 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.484 ' HA ' ' HD2' ' A' ' 6' ' ' PRO . 14.0 pt20 -125.47 117.59 24.91 Favored Pre-proline 0 C--N 1.322 -0.629 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 -167.225 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.504 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 18.1 Cg_endo -62.34 106.71 0.5 Allowed 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 122.0 1.8 . . . . 0.0 109.155 166.246 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 75.4 m -89.55 -90.72 0.14 Allowed 'General case' 0 N--CA 1.434 -1.236 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -165.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.404 ' H ' HG12 ' A' ' 40' ' ' VAL . 11.2 mpt_? -101.05 153.41 19.58 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.206 0.527 . . . . 0.0 111.506 -170.639 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.59 ' HA ' ' HA ' ' A' ' 39' ' ' ARG . 30.8 m -104.99 131.86 51.96 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.519 177.354 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.409 ' HE2' ' HB ' ' A' ' 40' ' ' VAL . 43.5 m-85 -115.21 132.33 56.64 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 -179.564 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.477 ' HG3' HG23 ' A' ' 72' ' ' VAL . 25.5 ptt180 -99.54 145.97 26.91 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.066 0.46 . . . . 0.0 110.994 -177.706 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.574 HG12 ' CD2' ' A' ' 71' ' ' LEU . 18.0 mt -93.53 119.26 41.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.281 -177.455 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 7.4 p -92.83 -19.06 22.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.8 0.333 . . . . 0.0 111.577 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.42 ' HA2' ' HB3' ' A' ' 34' ' ' PRO . . . 164.82 -151.84 21.09 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.099 179.301 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -115.58 152.84 32.3 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.882 0.372 . . . . 0.0 110.281 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.53 ' O ' HG22 ' A' ' 19' ' ' ILE . 49.2 m -78.83 150.76 75.87 Favored Pre-proline 0 N--CA 1.442 -0.846 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.497 179.433 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -70.48 11.25 0.49 Allowed 'Trans proline' 0 N--CA 1.474 0.379 0 C-N-CA 123.161 2.574 . . . . 0.0 113.598 -176.061 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -106.23 1.82 26.35 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.757 0.313 . . . . 0.0 111.04 179.02 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.53 HG22 ' O ' ' A' ' 16' ' ' SER . 16.4 tt -89.28 143.18 11.71 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 CA-C-O 120.942 0.401 . . . . 0.0 110.735 -179.053 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 21.2 t -156.41 -174.87 5.14 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 -178.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 61.37 -155.88 0.35 Allowed 'General case' 0 CA--C 1.537 0.472 0 O-C-N 123.467 0.48 . . . . 0.0 109.768 179.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -90.17 23.64 20.19 Favored Glycine 0 CA--C 1.519 0.289 0 C-N-CA 120.896 -0.668 . . . . 0.0 112.034 178.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.469 ' CE1' HD12 ' A' ' 68' ' ' LEU . 6.3 t80 -68.45 -38.0 80.72 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.865 0.365 . . . . 0.0 110.486 -176.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 15.5 ttm180 -64.62 -38.96 92.8 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.804 178.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -69.72 -32.22 70.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.733 179.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.3 tpp180 -65.59 -44.16 87.48 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 175.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.456 HD22 HD12 ' A' ' 32' ' ' LEU . 89.2 mt -66.84 -41.97 86.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.472 179.498 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -56.29 -44.76 80.17 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.274 177.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 50.8 m -61.6 -33.35 73.75 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.25 178.105 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 85.1 mtp -82.52 -11.76 58.24 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.37 -179.133 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 94.61 11.16 57.27 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.835 -0.697 . . . . 0.0 111.946 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.456 HD12 HD22 ' A' ' 27' ' ' LEU . 86.7 mt -92.2 90.08 7.16 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.278 0.561 . . . . 0.0 109.787 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.3 pp -145.32 161.05 43.36 Favored Pre-proline 0 C--N 1.321 -0.674 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.773 -175.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.42 ' HB3' ' HA2' ' A' ' 14' ' ' GLY . 14.7 Cg_endo -58.03 128.15 27.74 Favored 'Trans proline' 0 C--O 1.235 0.351 0 C-N-CA 122.861 2.374 . . . . 0.0 112.011 177.192 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 111.96 -14.19 26.5 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.953 -0.642 . . . . 0.0 111.631 -176.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.528 ' HB3' HD12 ' A' ' 12' ' ' ILE . . . -93.13 -179.86 5.21 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-O 121.114 0.483 . . . . 0.0 110.16 178.587 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -154.97 146.5 23.14 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.694 -177.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 57.1 mt -130.89 132.77 45.35 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.805 177.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.59 ' HA ' ' HA ' ' A' ' 9' ' ' SER . 79.5 ttt180 -100.06 127.44 46.29 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.304 -0.407 . . . . 0.0 109.953 178.687 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.504 ' O ' ' HA ' ' A' ' 6' ' ' PRO . 5.1 p -66.53 120.84 14.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 121.254 0.549 . . . . 0.0 109.967 -179.37 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.822 ' HB ' ' HG2' ' A' ' 51' ' ' GLN . 43.0 t -92.62 -59.43 3.01 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.922 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.547 173.165 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 56.0 mtm180 -156.23 160.38 39.76 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.202 0.525 . . . . 0.0 112.099 -179.02 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 80.4 mt -129.62 135.11 62.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 172.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.543 ' H ' ' HD2' ' A' ' 49' ' ' PRO . . . -71.84 153.79 92.97 Favored Pre-proline 0 C--N 1.327 -0.389 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -176.284 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 25.9 Cg_exo -63.61 -17.65 60.89 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 123.678 2.919 . . . . 0.0 113.499 -179.144 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 7.1 tt -46.99 -50.4 19.21 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.958 0.885 . . . . 0.0 109.985 175.374 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.92 -46.39 0.57 Allowed Glycine 0 N--CA 1.432 -1.624 0 N-CA-C 109.799 -1.321 . . . . 0.0 109.799 -172.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -174.42 117.36 0.34 Allowed Pre-proline 0 N--CA 1.449 -0.479 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 174.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.543 ' HD2' ' H ' ' A' ' 44' ' ' ALA . 69.4 Cg_endo -115.65 -172.87 0.02 OUTLIER 'Trans proline' 0 N--CA 1.438 -1.753 1 C-N-CA 126.969 5.112 . . . . 0.0 106.637 132.43 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.734 HG22 HG13 ' A' ' 52' ' ' VAL . 50.8 mt -140.81 117.15 7.55 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.446 0 C-N-CA 118.866 -1.134 . . . . 0.0 111.24 175.898 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.822 ' HG2' ' HB ' ' A' ' 41' ' ' VAL . 32.4 tt0 -96.55 118.32 32.79 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.051 -0.977 . . . . 0.0 108.492 174.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.734 HG13 HG22 ' A' ' 50' ' ' ILE . 15.4 m -135.81 165.9 28.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.393 0.616 . . . . 0.0 112.212 -176.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -112.91 126.14 55.14 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.06 175.527 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.4 t -82.85 -28.33 30.18 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.04 178.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.49 -43.42 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 114.982 -1.008 . . . . 0.0 108.644 177.471 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -130.21 -37.1 1.47 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.705 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.7 t -106.83 158.76 16.75 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.738 -177.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.431 ' HA ' ' O ' ' A' ' 52' ' ' VAL . 15.3 m -101.82 157.53 16.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.67 -177.26 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.52 ' O ' ' HA ' ' A' ' 51' ' ' GLN . 8.7 mt -135.71 163.82 29.29 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.061 0.458 . . . . 0.0 111.465 179.121 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.569 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -140.73 135.51 31.63 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.333 175.098 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -159.49 178.65 9.67 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 -175.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.447 ' HA ' ' HD3' ' A' ' 62' ' ' ARG . 9.8 mmt85 -109.43 169.1 8.92 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.7 0.762 . . . . 0.0 112.299 179.516 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.1 ptp180 -60.81 -37.55 82.39 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.181 -1.372 . . . . 0.0 112.328 -174.501 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -59.81 -46.56 88.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.164 0.507 . . . . 0.0 110.678 178.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -66.48 -37.08 84.31 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.159 -176.29 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.573 HD22 ' CD1' ' A' ' 50' ' ' ILE . 4.6 tp -71.4 -38.71 71.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.692 176.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.07 -21.94 65.86 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.727 -0.669 . . . . 0.0 112.121 -175.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.469 HD12 ' CE1' ' A' ' 23' ' ' TYR . 60.5 mt -79.2 -12.71 59.97 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.456 -0.497 . . . . 0.0 110.555 177.144 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.403 HD11 HD13 ' A' ' 32' ' ' LEU . 82.2 mt -97.09 138.03 35.23 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 171.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 17.7 m -88.4 113.87 24.44 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 173.39 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.574 ' CD2' HG12 ' A' ' 12' ' ' ILE . 77.3 mt -116.86 134.1 55.19 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.907 -175.28 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.477 HG23 ' HG3' ' A' ' 11' ' ' ARG . 29.4 m -125.51 138.92 32.77 Favored Pre-proline 0 C--N 1.317 -0.825 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 172.026 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -65.04 165.02 22.89 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 121.669 1.579 . . . . 0.0 111.286 177.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 9' ' ' SER . 89.6 mt -51.9 -31.59 29.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.525 174.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 38.2 t70 . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.524 -0.751 . . . . 0.0 110.654 178.655 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.412 ' HB3' ' H ' ' A' ' 2' ' ' SER . 93.8 mtp . . . . . 0 N--CA 1.485 1.308 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.412 ' H ' ' HB3' ' A' ' 1' ' ' MET . 8.1 p -69.22 89.63 0.47 Allowed 'General case' 0 C--O 1.235 0.307 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -176.365 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.534 ' HA ' ' HD3' ' A' ' 42' ' ' ARG . . . 67.0 140.42 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.555 0.742 . . . . 0.0 112.635 177.043 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.512 ' HG ' ' H ' ' A' ' 5' ' ' GLN . 10.0 tp 57.57 -147.45 0.52 Allowed 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.234 179.496 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.512 ' H ' ' HG ' ' A' ' 4' ' ' LEU . 61.0 tt0 65.88 70.99 0.51 Allowed Pre-proline 0 N--CA 1.463 0.212 0 CA-C-O 121.483 0.659 . . . . 0.0 110.012 -173.356 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.758 ' HB2' HG13 ' A' ' 40' ' ' VAL . 85.2 Cg_endo -98.3 170.08 0.65 Allowed 'Trans proline' 0 N--CA 1.447 -1.234 0 C-N-CA 123.269 2.646 . . . . 0.0 112.879 -178.76 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.527 ' O ' ' HG3' ' A' ' 8' ' ' ARG . 36.5 t -91.3 -87.95 0.19 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.77 174.485 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.527 ' HG3' ' O ' ' A' ' 7' ' ' SER . 39.1 mtp85 -155.36 153.12 29.98 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 179.758 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.501 ' HB2' ' CD1' ' A' ' 74' ' ' LEU . 52.1 m -63.24 146.1 54.12 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.252 0.549 . . . . 0.0 111.058 -177.255 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -117.27 125.2 50.72 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.996 -177.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.553 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . 26.2 ptt180 -95.01 154.18 17.29 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.069 0.461 . . . . 0.0 110.716 -178.217 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.502 HG12 ' CD2' ' A' ' 71' ' ' LEU . 18.4 mt -94.89 119.45 42.94 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.117 -177.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 4.5 p -94.46 -17.86 22.06 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.637 0.256 . . . . 0.0 111.254 179.012 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 1.001 ' HA2' ' HG3' ' A' ' 34' ' ' PRO . . . 161.32 -161.12 32.8 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.44 -0.886 . . . . 0.0 112.283 177.805 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 65.8 m-85 -110.47 156.39 20.92 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.605 -0.516 . . . . 0.0 109.605 177.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.482 ' O ' HG22 ' A' ' 19' ' ' ILE . 49.1 m -72.77 132.17 83.45 Favored Pre-proline 0 N--CA 1.442 -0.838 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 174.376 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -63.82 2.53 0.99 Allowed 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 123.325 2.683 . . . . 0.0 113.746 -174.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.01 -9.31 37.26 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.018 177.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.707 HD12 ' HB3' ' A' ' 68' ' ' LEU . 11.8 tt -84.49 143.54 11.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.107 0.48 . . . . 0.0 110.784 -178.247 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 41.2 m -84.12 158.24 21.45 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.354 177.355 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -63.74 -37.5 87.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.537 -173.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.47 ' O ' ' HB2' ' A' ' 25' ' ' GLN . . . -64.08 -41.27 98.55 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.679 -178.052 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -75.51 -32.87 60.67 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 178.427 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 40.3 ttt-85 -58.58 -35.39 72.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.437 172.469 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.47 ' HB2' ' O ' ' A' ' 22' ' ' GLY . 21.0 mt-30 -65.12 -33.5 76.17 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.621 177.231 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.6 tmm_? -66.01 -41.32 91.14 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.089 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 96.2 mt -69.1 -44.67 71.99 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.447 178.386 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -59.4 -43.94 92.91 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.83 179.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.4 m -63.59 -32.95 74.57 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.935 178.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 77.5 mtp -77.5 -15.82 59.08 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.094 178.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 95.29 15.87 42.68 Favored Glycine 0 N--CA 1.446 -0.681 0 C-N-CA 120.877 -0.678 . . . . 0.0 111.93 178.612 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.432 HD13 HD11 ' A' ' 69' ' ' LEU . 90.8 mt -92.69 79.44 4.79 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.62 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.6 pp -132.97 162.08 59.79 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.98 -173.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 1.001 ' HG3' ' HA2' ' A' ' 14' ' ' GLY . 35.2 Cg_exo -58.46 122.07 11.04 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.785 2.323 . . . . 0.0 112.119 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.46 -17.05 9.69 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.344 -179.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -94.6 -176.11 3.81 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 177.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 11' ' ' ARG . . . -157.34 138.95 13.97 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.957 -177.633 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.425 ' N ' HD22 ' A' ' 38' ' ' LEU . 2.5 mm? -99.65 135.8 40.53 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 176.142 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.455 HH11 ' HD2' ' A' ' 39' ' ' ARG . 21.8 ttt180 -96.18 111.24 23.35 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.834 -178.423 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.758 HG13 ' HB2' ' A' ' 6' ' ' PRO . 7.8 p -60.48 127.08 19.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.438 0.637 . . . . 0.0 111.495 -177.424 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 49.6 t -103.55 -55.2 5.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.472 173.136 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.534 ' HD3' ' HA ' ' A' ' 3' ' ' ALA . 48.4 mtm180 -152.33 168.09 26.54 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.87 179.47 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.418 HG13 HG23 ' A' ' 50' ' ' ILE . 4.7 mp -124.49 139.37 50.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 174.049 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.469 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . . . -68.82 135.29 89.99 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 120.633 0.254 . . . . 0.0 110.461 178.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.469 ' HD3' ' HA ' ' A' ' 44' ' ' ALA . 23.9 Cg_exo -65.74 -1.57 5.18 Favored 'Trans proline' 0 N--CA 1.475 0.419 0 C-N-CA 123.117 2.545 . . . . 0.0 113.195 -178.315 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -94.38 -16.94 23.03 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.812 179.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.48 ' O ' ' HD2' ' A' ' 63' ' ' ARG . . . 91.88 -9.53 76.5 Favored Glycine 0 N--CA 1.454 -0.15 0 N-CA-C 110.417 -1.073 . . . . 0.0 110.417 -171.178 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.878 ' HB3' ' HD2' ' A' ' 49' ' ' PRO . 6.5 m-20 -74.2 171.55 10.88 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 114.022 -1.089 . . . . 0.0 110.285 174.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.878 ' HD2' ' HB3' ' A' ' 48' ' ' ASP . 14.4 Cg_exo -24.43 152.13 0.0 OUTLIER 'Trans proline' 0 C--N 1.362 1.289 1 C-N-CA 126.316 4.678 . . . . 0.0 117.291 -167.665 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.509 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 71.0 mt -109.89 138.3 38.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-N 113.638 -1.619 . . . . 0.0 109.602 -171.345 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -86.72 108.92 18.89 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 35.8 m -121.18 -179.43 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.488 ' HA ' ' HA ' ' A' ' 58' ' ' SER . 34.0 tt0 -136.87 134.36 36.79 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 179.648 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.0 p -84.07 -45.86 12.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.325 0.583 . . . . 0.0 110.317 -177.105 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 28.8 ttm180 -161.8 -59.19 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.331 -0.849 . . . . 0.0 108.98 177.038 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -111.3 -39.27 4.75 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.308 177.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.8 t -103.06 149.87 24.15 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.912 0.387 . . . . 0.0 111.135 -172.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.488 ' HA ' ' HA ' ' A' ' 53' ' ' GLU . 21.3 m -95.17 152.09 18.65 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.576 179.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 53.1 tp -143.17 146.82 34.05 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.897 -177.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.509 ' HA ' ' O ' ' A' ' 50' ' ' ILE . . . -112.28 124.82 53.3 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.95 176.658 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.66 HD13 HD13 ' A' ' 66' ' ' LEU . 1.3 pp -109.66 125.63 52.82 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.066 0.46 . . . . 0.0 110.584 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.438 ' HG3' ' HG3' ' A' ' 49' ' ' PRO . 2.9 mpt_? -67.24 171.98 5.24 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.068 -177.743 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.48 ' HD2' ' O ' ' A' ' 47' ' ' GLY . 0.0 OUTLIER -67.27 -44.52 79.13 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.589 179.445 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 60.0 tttp -70.71 -40.37 72.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.972 0.415 . . . . 0.0 110.324 177.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -63.75 -35.23 79.88 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.967 178.386 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.66 HD13 HD13 ' A' ' 61' ' ' LEU . 40.7 tp -68.81 -38.13 79.71 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.561 174.468 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.01 -15.43 63.02 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.903 -176.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.707 ' HB3' HD12 ' A' ' 19' ' ' ILE . 72.0 mt -83.87 -24.75 30.73 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.011 0.434 . . . . 0.0 110.751 177.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.432 HD11 HD13 ' A' ' 32' ' ' LEU . 87.8 mt -102.81 141.77 35.06 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.446 179.652 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.1 m -96.42 113.42 25.0 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 170.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.502 ' CD2' HG12 ' A' ' 12' ' ' ILE . 51.7 mt -121.19 137.1 54.83 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.628 -176.263 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 34.6 m -132.36 150.24 75.37 Favored Pre-proline 0 C--N 1.321 -0.653 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 174.053 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -60.21 163.75 13.95 Favored 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 121.863 1.708 . . . . 0.0 111.716 177.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.501 ' CD1' ' HB2' ' A' ' 9' ' ' SER . 74.8 mt -66.22 -12.17 54.48 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.022 175.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.3 t70 . . . . . 0 C--O 1.249 1.033 0 O-C-N 124.285 0.991 . . . . 0.0 110.311 -178.095 . . . . . . . . 0 0 . 1 stop_ save_